1-[3,4-bis(oxidanyl)phenyl]-2-(1-phenylpropan-2-ylamino)ethanone hydrochloride

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(1-phenylpropan-2-ylamino)ethanone hydrochloride Openeye Name: 1-(3,4-dihydroxyphenyl)-2-[(1-methyl-2-phenyl-ethyl)amino]ethanone hydrochloride CAS Name: 1-(3,4-dihydroxyphenyl)-2-(1-phenylpropan-2-ylamino)ethanone hydrochloride IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(1-phenylpropan-2-ylamino)ethanone hydrochloride Traditional Name: 1-(3,4-dihydroxyphenyl)-2-[(1-methyl-2-phenyl-ethyl)amino]ethanone hydrochloride Formula: C17H20ClNO3 MolecularWeight: 321.7986

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NCC(=O)C2=CC(=C(C=C2)O)O.Cl

Isomeric SMILES

CC(CC1=CC=CC=C1)NCC(=O)C2=CC(=C(C=C2)O)O.Cl

InChI

InChI=1S/C17H19NO3.ClH/c1-12(9-13-5-3-2-4-6-13)18-11-17(21)14-7-8-15(19)16(20)10-14;/h2-8,10,12,18-20H,9,11H2,1H3;1H