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: NKKQBJDCFWZFFP (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2122073

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H32N2/c1-18(2)8-7-9-19(3)16-21-12-14-22(15-13-21)17-20-10-5-4-6-11-20/h4-6,8,10-11,19H,7,9,12-17H2,1-3H3
C20H32N2300.48148161200
5693311

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H32N2/c1-18(2)8-7-9-19(3)16-21-12-14-22(15-13-21)17-20-10-5-4-6-11-20/h4-6,8,10-11,19H,7,9,12-17H2,1-3H3/t19-/m0/s1
C20H32N2300.48152100
5693313

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H32N2/c1-18(2)8-7-9-19(3)16-21-12-14-22(15-13-21)17-20-10-5-4-6-11-20/h4-6,8,10-11,19H,7,9,12-17H2,1-3H3/t19-/m1/s1
C20H32N2300.48152100
5693312

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H32N2/c1-18(2)8-7-9-19(3)16-21-12-14-22(15-13-21)17-20-10-5-4-6-11-20/h4-6,8,10-11,19H,7,9,12-17H2,1-3H3/p+2/t19-/m1/s1
C20H34N2302.49631100
5693310

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H32N2/c1-18(2)8-7-9-19(3)16-21-12-14-22(15-13-21)17-20-10-5-4-6-11-20/h4-6,8,10-11,19H,7,9,12-17H2,1-3H3/p+2/t19-/m0/s1
C20H34N2302.49631100

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