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 6 results

Search term: HEMNASNJLGAVFA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
22870641

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C17H22O3/c1-12-7-8-17(10-18)9-15(12)16(20-11-17)13-3-5-14(19-2)6-4-13/h3-7,15-16,18H,8-11H2,1-2H3/t15-,16?,17-/m1/s1
C17H22O3274.354811800
2952253

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C17H22O3/c1-12-7-8-17(10-18)9-15(12)16(20-11-17)13-3-5-14(19-2)6-4-13/h3-7,15-16,18H,8-11H2,1-2H3
C17H22O3274.354789600
17461245

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C17H22O3/c1-12-7-8-17(10-18)9-15(12)16(20-11-17)13-3-5-14(19-2)6-4-13/h3-7,15-16,18H,8-11H2,1-2H3/t15-,16?,17+/m0/s1
C17H22O3274.35482200
651584

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H22O3/c1-12-7-8-17(10-18)9-15(12)16(20-11-17)13-3-5-14(19-2)6-4-13/h3-7,15-16,18H,8-11H2,1-2H3/t15-,16+,17+/m0/s1
C17H22O3274.35482100
809349

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C17H22O3/c1-12-7-8-17(10-18)9-15(12)16(20-11-17)13-3-5-14(19-2)6-4-13/h3-7,15-16,18H,8-11H2,1-2H3/t15-,16-,17+/m0/s1
C17H22O3274.35482100
64849991

1 of 3 defined stereocentres - 1/3 defined
InChI=1/C17H22O3/c1-12-7-8-17(10-18)9-15(12)16(20-11-17)13-3-5-14(19-2)6-4-13/h3-7,15-16,18H,8-11H2,1-2H3/t15?,16?,17-/m1/s1
C17H22O3274.35481200

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