1-[3,4-bis(oxidanyl)phenyl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 1-[3,4-bis(oxidanyl)phenyl]-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dihydroxyphenyl)ethanone CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dihydroxyphenyl)ethanone IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dihydroxyphenyl)ethanone Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dihydroxyphenyl)ethanone Formula: C17H17NO3 MolecularWeight: 283.32178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(=O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C17H17NO3/c19-15-6-5-13(9-16(15)20)17(21)11-18-8-7-12-3-1-2-4-14(12)10-18/h1-6,9,19-20H,7-8,10-11H2