methyl 2-[(3,5-dimethoxyphenyl)carbonylamino]-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: methyl 2-[(3,5-dimethoxyphenyl)carbonylamino]-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: methyl 2-[(3,5-dimethoxybenzoyl)amino]-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-1-oxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3,5-dimethoxybenzoyl)amino]-1-oxoisoquinoline-4-carboxylate Traditional Name: 2-[(3,5-dimethoxybenzoyl)amino]-1-keto-isoquinoline-4-carboxylic acid methyl ester Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NN2C=C(C3=CC=CC=C3C2=O)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NN2C=C(C3=CC=CC=C3C2=O)C(=O)OC)OC

InChI

InChI=1S/C20H18N2O6/c1-26-13-8-12(9-14(10-13)27-2)18(23)21-22-11-17(20(25)28-3)15-6-4-5-7-16(15)19(22)24/h4-11H,1-3H3,(H,21,23)