[2-oxidanylidene-2-(4-propylphenyl)ethyl] quinoline-2-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)COC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)COC(=O)C2=NC3=CC=CC=C3C=C2

InChI

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