2-[6-cyano-5-(4-methylphenyl)-8-oxidanylidene-1,7-naphthyridin-7-yl]ethanoic acid

Systemtic Name: 2-[6-cyano-5-(4-methylphenyl)-8-oxidanylidene-1,7-naphthyridin-7-yl]ethanoic acid Openeye Name: 2-[6-cyano-8-oxo-5-(p-tolyl)-1,7-naphthyridin-7-yl]acetic acid CAS Name: 2-[6-cyano-5-(4-methylphenyl)-8-oxo-1,7-naphthyridin-7-yl]acetic acid IUPAC Name: 2-[6-cyano-5-(4-methylphenyl)-8-oxo-1,7-naphthyridin-7-yl]acetic acid Traditional Name: 2-[6-cyano-8-keto-5-(p-tolyl)-1,7-naphthyridin-7-yl]acetic acid Formula: C18H13N3O3 MolecularWeight: 319.31412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N(C(=O)C3=C2C=CC=N3)CC(=O)O)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N(C(=O)C3=C2C=CC=N3)CC(=O)O)C#N

InChI

InChI=1S/C18H13N3O3/c1-11-4-6-12(7-5-11)16-13-3-2-8-20-17(13)18(24)21(10-15(22)23)14(16)9-19/h2-8H,10H2,1H3,(H,22,23)