1-[3,4-bis(oxidanyl)phenyl]-2-(4-phenylbutan-2-ylamino)propan-1-one hydrochloride

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(4-phenylbutan-2-ylamino)propan-1-one hydrochloride Openeye Name: 1-(3,4-dihydroxyphenyl)-2-[(1-methyl-3-phenyl-propyl)amino]propan-1-one hydrochloride CAS Name: 1-(3,4-dihydroxyphenyl)-2-(4-phenylbutan-2-ylamino)-1-propanone hydrochloride IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(4-phenylbutan-2-ylamino)propan-1-one hydrochloride Traditional Name: 1-(3,4-dihydroxyphenyl)-2-[(1-methyl-3-phenyl-propyl)amino]propan-1-one hydrochloride Formula: C19H24ClNO3 MolecularWeight: 349.85176

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(C)C(=O)C2=CC(=C(C=C2)O)O.Cl

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(C)C(=O)C2=CC(=C(C=C2)O)O.Cl

InChI

InChI=1S/C19H23NO3.ClH/c1-13(8-9-15-6-4-3-5-7-15)20-14(2)19(23)16-10-11-17(21)18(22)12-16;/h3-7,10-14,20-22H,8-9H2,1-2H3;1H