(3-butanoyl-4-chloranyl-quinolin-6-yl)methyl benzoate

Systemtic Name: (3-butanoyl-4-chloranyl-quinolin-6-yl)methyl benzoate Openeye Name: (3-butanoyl-4-chloro-6-quinolyl)methyl benzoate CAS Name: benzoic acid [4-chloro-3-(1-oxobutyl)-6-quinolinyl]methyl ester IUPAC Name: (3-butanoyl-4-chloroquinolin-6-yl)methyl benzoate Traditional Name: benzoic acid (3-butyryl-4-chloro-6-quinolyl)methyl ester Formula: C21H18ClNO3 MolecularWeight: 367.82552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C=CC(=CC2=C1Cl)COC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)C1=CN=C2C=CC(=CC2=C1Cl)COC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18ClNO3/c1-2-6-19(24)17-12-23-18-10-9-14(11-16(18)20(17)22)13-26-21(25)15-7-4-3-5-8-15/h3-5,7-12H,2,6,13H2,1H3