methyl 2-[(5-chloranyl-2-methoxy-phenyl)carbonylamino]-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: methyl 2-[(5-chloranyl-2-methoxy-phenyl)carbonylamino]-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: methyl 2-[(5-chloro-2-methoxy-benzoyl)amino]-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-[[(5-chloro-2-methoxyphenyl)-oxomethyl]amino]-1-oxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-2-methoxybenzoyl)amino]-1-oxoisoquinoline-4-carboxylate Traditional Name: 2-[(5-chloro-2-methoxy-benzoyl)amino]-1-keto-isoquinoline-4-carboxylic acid methyl ester Formula: C19H15ClN2O5 MolecularWeight: 386.7858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClN2O5/c1-26-16-8-7-11(20)9-14(16)17(23)21-22-10-15(19(25)27-2)12-5-3-4-6-13(12)18(22)24/h3-10H,1-2H3,(H,21,23)