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

Systemtic Name: methyl 2-[[2-(4-methoxyphenyl)-1-oxidanylidene-isoquinolin-4-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carbonyl]amino]benzoate CAS Name: 2-[[[2-(4-methoxyphenyl)-1-oxo-4-isoquinolinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carbonyl]amino]benzoate Traditional Name: 2-[[1-keto-2-(4-methoxyphenyl)isoquinoline-4-carbonyl]amino]benzoic acid methyl ester Formula: C25H20N2O5 MolecularWeight: 428.4367

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC=CC=C4C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C25H20N2O5/c1-31-17-13-11-16(12-14-17)27-15-21(18-7-3-4-8-19(18)24(27)29)23(28)26-22-10-6-5-9-20(22)25(30)32-2/h3-15H,1-2H3,(H,26,28)