pentyl 8-chloranyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: pentyl 8-chloranyl-2-phenyl-quinoline-4-carboxylate Openeye Name: pentyl 8-chloro-2-phenyl-quinoline-4-carboxylate CAS Name: 8-chloro-2-phenyl-4-quinolinecarboxylic acid pentyl ester IUPAC Name: pentyl 8-chloro-2-phenylquinoline-4-carboxylate Traditional Name: 8-chloro-2-phenyl-cinchoninic acid amyl ester Formula: C21H20ClNO2 MolecularWeight: 353.842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2Cl)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H20ClNO2/c1-2-3-7-13-25-21(24)17-14-19(15-9-5-4-6-10-15)23-20-16(17)11-8-12-18(20)22/h4-6,8-12,14H,2-3,7,13H2,1H3