2-[(4-methoxyphenyl)carbonylamino]-1-oxidanylidene-isoquinoline-4-carboxylic acid

Systemtic Name: 2-[(4-methoxyphenyl)carbonylamino]-1-oxidanylidene-isoquinoline-4-carboxylic acid Openeye Name: 2-[(4-methoxybenzoyl)amino]-1-oxo-isoquinoline-4-carboxylic acid CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-1-oxo-4-isoquinolinecarboxylic acid IUPAC Name: 2-[(4-methoxybenzoyl)amino]-1-oxoisoquinoline-4-carboxylic acid Traditional Name: 1-keto-2-(p-anisoylamino)isoquinoline-4-carboxylic acid Formula: C18H14N2O5 MolecularWeight: 338.31416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O5/c1-25-12-8-6-11(7-9-12)16(21)19-20-10-15(18(23)24)13-4-2-3-5-14(13)17(20)22/h2-10H,1H3,(H,19,21)(H,23,24)