Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 10 results

Search term: CCIDTXJAPRZHSL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
31046927

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/t11-,12-,13-,14+,19+/m0/s1
C21H30Cl3NO10562.8226161500
9072297

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/b25-20+/t11-,12-,13-,14+,19+/m0/s1
C21H30Cl3NO10562.82263200
22543159

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3
C21H30Cl3NO10562.82263100
107441573

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/t11-,12?,13-,14+,19+/m0/s1
C21H30Cl3NO10562.82262500
107446859

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/t11-,12?,13-,14+,19-/m0/s1
C21H30Cl3NO10562.82261400
34977477

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/t11-,12+,13+,14+,19+/m1/s1
C21H30Cl3NO10562.82261100
78432756

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/b25-20+
C21H30Cl3NO10562.82261100
78432766

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/b25-20+/t11-,12-,13?,14-,19+/m0/s1
C21H30Cl3NO10562.82261100
78433614

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H30Cl3NO10/c1-8(2)15(26)31-11-12(32-16(27)9(3)4)14(33-17(28)10(5)6)19(34-13(11)18(29)30-7)35-20(25)21(22,23)24/h8-14,19,25H,1-7H3/b25-20+/t11-,12?,13-,14+,19+/m0/s1
C21H30Cl3NO10562.82261100

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