[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: [2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid [2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C31H28N2O3 MolecularWeight: 476.56562

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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)C=C4C(C5=CC=CC=C5N4C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)C=C4C(C5=CC=CC=C5N4C)(C)C

InChI

InChI=1S/C31H28N2O3/c1-20-13-15-21(16-14-20)27-18-24(23-9-5-7-11-26(23)32-27)30(35)36-19-22(34)17-29-31(2,3)25-10-6-8-12-28(25)33(29)4/h5-18H,19H2,1-4H3