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

Systemtic Name: methyl 2-[(6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinolin-4-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(6,7-dimethoxy-2-methyl-1-oxo-isoquinoline-4-carbonyl)amino]benzoate CAS Name: 2-[[(6,7-dimethoxy-2-methyl-1-oxo-4-isoquinolinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(6,7-dimethoxy-2-methyl-1-oxoisoquinoline-4-carbonyl)amino]benzoate Traditional Name: 2-[(1-keto-6,7-dimethoxy-2-methyl-isoquinoline-4-carbonyl)amino]benzoic acid methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H20N2O6/c1-23-11-15(13-9-17(27-2)18(28-3)10-14(13)20(23)25)19(24)22-16-8-6-5-7-12(16)21(26)29-4/h5-11H,1-4H3,(H,22,24)