methyl 2-[(2-ethyl-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(2-ethyl-6,7-dimethoxy-1-oxidanylidene-isoquinolin-4-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(2-ethyl-6,7-dimethoxy-1-oxo-isoquinoline-4-carbonyl)amino]benzoate CAS Name: 2-[[(2-ethyl-6,7-dimethoxy-1-oxo-4-isoquinolinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(2-ethyl-6,7-dimethoxy-1-oxoisoquinoline-4-carbonyl)amino]benzoate Traditional Name: 2-[(2-ethyl-1-keto-6,7-dimethoxy-isoquinoline-4-carbonyl)amino]benzoic acid methyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H22N2O6/c1-5-24-12-16(14-10-18(28-2)19(29-3)11-15(14)21(24)26)20(25)23-17-9-7-6-8-13(17)22(27)30-4/h6-12H,5H2,1-4H3,(H,23,25)