(2-acetamido-2-oxidanylidene-ethyl) 2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: (2-acetamido-2-oxidanylidene-ethyl) 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: (2-acetamido-2-oxo-ethyl) 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid (2-acetamido-2-oxoethyl) ester IUPAC Name: (2-acetamido-2-oxoethyl) 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid (2-acetamido-2-keto-ethyl) ester Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)NC(=O)C

InChI

InChI=1S/C21H18N2O4/c1-13-7-9-15(10-8-13)19-11-17(16-5-3-4-6-18(16)23-19)21(26)27-12-20(25)22-14(2)24/h3-11H,12H2,1-2H3,(H,22,24,25)