3-phenylpropyl 2-(4-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: 3-phenylpropyl 2-(4-chlorophenyl)quinoline-4-carboxylate Openeye Name: 3-phenylpropyl 2-(4-chlorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-4-quinolinecarboxylic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 2-(4-chlorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)cinchoninic acid 3-phenylpropyl ester Formula: C25H20ClNO2 MolecularWeight: 401.8848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H20ClNO2/c26-20-14-12-19(13-15-20)24-17-22(21-10-4-5-11-23(21)27-24)25(28)29-16-6-9-18-7-2-1-3-8-18/h1-5,7-8,10-15,17H,6,9,16H2