2-(4-methylphenyl)-3-(2-oxidanidyl-2-oxidanylidene-ethyl)quinoline-4-carboxylate

Systemtic Name: 2-(4-methylphenyl)-3-(2-oxidanidyl-2-oxidanylidene-ethyl)quinoline-4-carboxylate Openeye Name: 3-(2-oxido-2-oxo-ethyl)-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-3-(2-oxido-2-oxoethyl)-4-quinolinecarboxylate IUPAC Name: 2-(4-methylphenyl)-3-(2-oxido-2-oxoethyl)quinoline-4-carboxylate Traditional Name: 3-(2-keto-2-oxido-ethyl)-2-(p-tolyl)cinchoninate Formula: C19H13NO4-2 MolecularWeight: 319.31082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C19H15NO4/c1-11-6-8-12(9-7-11)18-14(10-16(21)22)17(19(23)24)13-4-2-3-5-15(13)20-18/h2-9H,10H2,1H3,(H,21,22)(H,23,24)/p-2