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 5 results

Search term: PFLIGGWMYMSVHX (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2402726

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H22N2O/c1-4-6-17(18-13-16-7-5-12-20-16)14-8-10-15(11-9-14)19(2)3/h4-5,7-12,17-18H,1,6,13H2,2-3H3
C17H22N2O270.3694423000
673096

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H22N2O/c1-4-6-17(18-13-16-7-5-12-20-16)14-8-10-15(11-9-14)19(2)3/h4-5,7-12,17-18H,1,6,13H2,2-3H3/t17-/m1/s1
C17H22N2O270.36944200
673100

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H22N2O/c1-4-6-17(18-13-16-7-5-12-20-16)14-8-10-15(11-9-14)19(2)3/h4-5,7-12,17-18H,1,6,13H2,2-3H3/t17-/m0/s1
C17H22N2O270.36942100
5314664

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H22N2O/c1-4-6-17(18-13-16-7-5-12-20-16)14-8-10-15(11-9-14)19(2)3/h4-5,7-12,17-18H,1,6,13H2,2-3H3/p+1/t17-/m1/s1
C17H23N2O271.377321100
5314667

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H22N2O/c1-4-6-17(18-13-16-7-5-12-20-16)14-8-10-15(11-9-14)19(2)3/h4-5,7-12,17-18H,1,6,13H2,2-3H3/p+1/t17-/m0/s1
C17H23N2O271.377321100

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