methyl 2-[6,7-diethoxy-2-[(phenylmethyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[6,7-diethoxy-2-[(phenylmethyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[2-(benzylcarbamoyl)-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[6,7-diethoxy-2-[oxo-[(phenylmethyl)amino]methyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(benzylcarbamoyl)-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[2-(benzylcarbamoyl)-6,7-diethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(N(CCC2=C1)C(=O)NCC3=CC=CC=C3)CC(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C2C(N(CCC2=C1)C(=O)NCC3=CC=CC=C3)CC(=O)OC)OCC

InChI

InChI=1S/C24H30N2O5/c1-4-30-21-13-18-11-12-26(24(28)25-16-17-9-7-6-8-10-17)20(15-23(27)29-3)19(18)14-22(21)31-5-2/h6-10,13-14,20H,4-5,11-12,15-16H2,1-3H3,(H,25,28)