methyl 2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-8-carboxylate

Systemtic Name: methyl 2-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-8-carboxylate Openeye Name: methyl 2-[2-(4-methoxyanilino)-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-8-carboxylate CAS Name: 2-[2-(4-methoxyanilino)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-8-carboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-methoxyanilino)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-8-carboxylate Traditional Name: 2-[2-keto-2-(p-anisidino)ethyl]-3,4-dihydro-1H-isoquinoline-8-carboxylic acid methyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CN2CCC3=CC=CC(=C3C2)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CN2CCC3=CC=CC(=C3C2)C(=O)OC

InChI

InChI=1S/C20H22N2O4/c1-25-16-8-6-15(7-9-16)21-19(23)13-22-11-10-14-4-3-5-17(18(14)12-22)20(24)26-2/h3-9H,10-13H2,1-2H3,(H,21,23)