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 8 results

Search term: YRMCBQLZVBXOSJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4508271

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)/b6-4+/t12-,16+/m0/s1
C17H19N3O4329.3505141200
4746092

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)/b6-4+
C17H19N3O4329.35055600
2338389

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)
C17H19N3O4329.350465500
66208

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)/t12-,16+/m0/s1
C17H19N3O4329.35052100
5144993

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)/t12?,16-/m1/s1
C17H19N3O4329.35052100
23152206

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)/b6-4+/t12-,16?/m0/s1
C17H19N3O4329.35052200
62587721

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)/b6-4-/t12-,16+/m0/s1
C17H19N3O4329.35052200
62587722

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C17H19N3O4/c1-9-3-5-11-14(15(9)22)19-16(24-2)12-7-10(4-6-13(18)21)8-20(12)17(11)23/h3-6,8,12,16,19,22H,7H2,1-2H3,(H2,18,21)/b6-4+/t12-,16-/m0/s1
C17H19N3O4329.35052200

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