ethyl 3-[[2-(3-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[2-(3-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[2-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carbonyl]amino]benzoate CAS Name: 3-[[[2-(3-methoxyphenyl)-1-oxo-4-isoquinolinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3-methoxyphenyl)-1-oxoisoquinoline-4-carbonyl]amino]benzoate Traditional Name: 3-[[1-keto-2-(3-methoxyphenyl)isoquinoline-4-carbonyl]amino]benzoic acid ethyl ester Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H22N2O5/c1-3-33-26(31)17-8-6-9-18(14-17)27-24(29)23-16-28(19-10-7-11-20(15-19)32-2)25(30)22-13-5-4-12-21(22)23/h4-16H,3H2,1-2H3,(H,27,29)