(1-oxidanylidene-1-phenyl-butan-2-yl) 2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: 1-benzoylpropyl 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid 1-benzoylpropyl ester Formula: C27H23NO3 MolecularWeight: 409.47642

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H23NO3/c1-3-25(26(29)20-9-5-4-6-10-20)31-27(30)22-17-24(19-15-13-18(2)14-16-19)28-23-12-8-7-11-21(22)23/h4-17,25H,3H2,1-2H3