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
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Found 8 results

Search term: ZORKKCARNQAZRJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9307522

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/b12-4+/t14-,15-,17-,19+,21-/m0/s1
C21H26N2O4370.442110700
4946079

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/b12-4+/t14-,15+,17+,19+,21+/m1/s1
C21H26N2O4370.44218600
57256884

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/b12-4+/t14-,15?,17?,19-,21-/m0/s1
C21H26N2O4370.44216400
82965321

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/b12-4+/t14-,15?,17?,19-,21-/m1/s1
C21H26N2O4370.44212100
113063768

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/t14-,15+,17+,19+,21+/m1/s1
C21H26N2O4370.44212200
4476725

Double-bond stereo

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/b12-4+
C21H26N2O4370.44212200
114642630

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/t14-,15+,17-,19+,21-/m0/s1
C21H26N2O4370.44211100
114934672

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/b12-4+/t14-,15?,17-,19+,21-/m0/s1
C21H26N2O4370.44211200

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