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 4 results

Search term: XSMVABOOCARDLP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3397033

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H33N3O3S2/c1-4-33-20-14-12-19(13-15-20)30-26(32)24-21-10-5-6-11-22(21)35-25(24)28-27(30)34-16-23(31)29-17(2)8-7-9-18(29)3/h12-15,17-18H,4-11,16H2,1-3H3
C27H33N3O3S2511.69922191300
1407317

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33N3O3S2/c1-4-33-20-14-12-19(13-15-20)30-26(32)24-21-10-5-6-11-22(21)35-25(24)28-27(30)34-16-23(31)29-17(2)8-7-9-18(29)3/h12-15,17-18H,4-11,16H2,1-3H3/t17-,18+
C27H33N3O3S2511.69922100
1407318

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33N3O3S2/c1-4-33-20-14-12-19(13-15-20)30-26(32)24-21-10-5-6-11-22(21)35-25(24)28-27(30)34-16-23(31)29-17(2)8-7-9-18(29)3/h12-15,17-18H,4-11,16H2,1-3H3/t17-,18-/m0/s1
C27H33N3O3S2511.69922100
1407319

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C27H33N3O3S2/c1-4-33-20-14-12-19(13-15-20)30-26(32)24-21-10-5-6-11-22(21)35-25(24)28-27(30)34-16-23(31)29-17(2)8-7-9-18(29)3/h12-15,17-18H,4-11,16H2,1-3H3/t17-,18-/m1/s1
C27H33N3O3S2511.69922100

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