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

Systemtic Name: ethyl 2-[[2-cyclohexyl-3-(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinolin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 2-[[2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoate CAS Name: 2-[[[2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinolin-4-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-cyclohexyl-3-(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoate Traditional Name: 2-[[2-cyclohexyl-1-keto-3-(4-methoxyphenyl)-3,4-dihydroisoquinoline-4-carbonyl]amino]benzoic acid ethyl ester Formula: C32H34N2O5 MolecularWeight: 526.62276

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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)C4CCCCC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CCCCC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C32H34N2O5/c1-3-39-32(37)26-15-9-10-16-27(26)33-30(35)28-24-13-7-8-14-25(24)31(36)34(22-11-5-4-6-12-22)29(28)21-17-19-23(38-2)20-18-21/h7-10,13-20,22,28-29H,3-6,11-12H2,1-2H3,(H,33,35)