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

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(propan-2-ylamino)propan-1-one hydrochloride Openeye Name: 1-(3,4-dihydroxyphenyl)-2-(isopropylamino)propan-1-one hydrochloride CAS Name: 1-(3,4-dihydroxyphenyl)-2-(propan-2-ylamino)-1-propanone hydrochloride IUPAC Name: 1-(3,4-dihydroxyphenyl)-2-(propan-2-ylamino)propan-1-one hydrochloride Traditional Name: 1-(3,4-dihydroxyphenyl)-2-(isopropylamino)propan-1-one hydrochloride Formula: C12H18ClNO3 MolecularWeight: 259.72922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO3.ClH/c1-7(2)13-8(3)12(16)9-4-5-10(14)11(15)6-9;/h4-8,13-15H,1-3H3;1H