methyl 4-[(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]benzoate Openeye Name: methyl 4-[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]benzoate CAS Name: 4-[[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]benzoate Traditional Name: 4-[(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]benzoic acid methyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H20N2O4/c1-13(23)22-10-9-14-7-8-18(11-17(14)12-22)21-19(24)15-3-5-16(6-4-15)20(25)26-2/h3-8,11H,9-10,12H2,1-2H3,(H,21,24)