[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl] quinoline-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl] quinoline-2-carboxylate Openeye Name: [2-(4-isopropylphenyl)-2-oxo-ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-oxo-2-(4-propan-2-ylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-propan-2-ylphenyl)ethyl] quinoline-2-carboxylate Traditional Name: quinaldic acid (2-keto-2-p-cumenyl-ethyl) ester Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)COC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)COC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H19NO3/c1-14(2)15-7-9-17(10-8-15)20(23)13-25-21(24)19-12-11-16-5-3-4-6-18(16)22-19/h3-12,14H,13H2,1-2H3