[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C28H23NO3 MolecularWeight: 421.48712

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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)C4=CC5=C(CCC5)C=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC(=O)C4=CC5=C(CCC5)C=C4

InChI

InChI=1S/C28H23NO3/c1-18-9-11-20(12-10-18)26-16-24(23-7-2-3-8-25(23)29-26)28(31)32-17-27(30)22-14-13-19-5-4-6-21(19)15-22/h2-3,7-16H,4-6,17H2,1H3