methyl 2-[2-(3-methoxyphenyl)ethanoylamino]-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: methyl 2-[2-(3-methoxyphenyl)ethanoylamino]-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: methyl 2-[[2-(3-methoxyphenyl)acetyl]amino]-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-[[2-(3-methoxyphenyl)-1-oxoethyl]amino]-1-oxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3-methoxyphenyl)acetyl]amino]-1-oxoisoquinoline-4-carboxylate Traditional Name: 1-keto-2-[[2-(3-methoxyphenyl)acetyl]amino]isoquinoline-4-carboxylic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N2O5/c1-26-14-7-5-6-13(10-14)11-18(23)21-22-12-17(20(25)27-2)15-8-3-4-9-16(15)19(22)24/h3-10,12H,11H2,1-2H3,(H,21,23)