ethyl 2-[[3-(4-methoxyphenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinolin-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 2-[[3-(4-methoxyphenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinolin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 2-[[3-(4-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoate CAS Name: 2-[[[3-(4-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinolin-4-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[3-(4-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoate Traditional Name: 2-[[1-keto-3-(4-methoxyphenyl)-2-methyl-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoic acid ethyl ester Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H26N2O5/c1-4-34-27(32)21-11-7-8-12-22(21)28-25(30)23-19-9-5-6-10-20(19)26(31)29(2)24(23)17-13-15-18(33-3)16-14-17/h5-16,23-24H,4H2,1-3H3,(H,28,30)