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: CBHCDHNUZWWAPP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
5850

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3
C19H22N2S310.4564629353186
5407649

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3/t15-/m0/s1
C19H22N2S310.45644300
2793997

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3/p+1
C19H23N2S311.464323300
5407647

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3/t15-/m1/s1
C19H22N2S310.45643200
58784794

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3/i1D3
C19H19D3N2S313.47492300
5407648

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3/p+1/t15-/m0/s1
C19H23N2S311.46381100
5407646

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2S/c1-20-12-6-7-15(13-20)14-21-16-8-2-4-10-18(16)22-19-11-5-3-9-17(19)21/h2-5,8-11,15H,6-7,12-14H2,1H3/p+1/t15-/m1/s1
C19H23N2S311.46381100

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