butyl 4-(4-chloranylpentanoylamino)benzoate

Systemtic Name: butyl 4-(4-chloranylpentanoylamino)benzoate Openeye Name: butyl 4-(4-chloropentanoylamino)benzoate CAS Name: 4-[(4-chloro-1-oxopentyl)amino]benzoic acid butyl ester IUPAC Name: butyl 4-(4-chloropentanoylamino)benzoate Traditional Name: 4-(4-chloropentanoylamino)benzoic acid butyl ester Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCC(C)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCC(C)Cl

InChI

InChI=1S/C16H22ClNO3/c1-3-4-11-21-16(20)13-6-8-14(9-7-13)18-15(19)10-5-12(2)17/h6-9,12H,3-5,10-11H2,1-2H3,(H,18,19)