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

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(diethylamino)ethanone hydrochloride Openeye Name: 2-(diethylamino)-1-(3,4-dihydroxyphenyl)ethanone hydrochloride CAS Name: 2-(diethylamino)-1-(3,4-dihydroxyphenyl)ethanone hydrochloride IUPAC Name: 2-(diethylamino)-1-(3,4-dihydroxyphenyl)ethanone hydrochloride Traditional Name: 2-(diethylamino)-1-(3,4-dihydroxyphenyl)ethanone hydrochloride Formula: C12H18ClNO3 MolecularWeight: 259.72922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO3.ClH/c1-3-13(4-2)8-12(16)9-5-6-10(14)11(15)7-9;/h5-7,14-15H,3-4,8H2,1-2H3;1H