ethyl 8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoate

Systemtic Name: ethyl 8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoate Openeye Name: ethyl 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]octanoate CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridinyl)propyl]octanoic acid ethyl ester IUPAC Name: ethyl 8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoate Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]caprylic acid ethyl ester Formula: C24H33ClN2O4S MolecularWeight: 481.04782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(CCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)CCCC2=CN=CC=C2

Isomeric SMILES

CCOC(=O)CCC(CCCCNS(=O)(=O)C1=CC=C(C=C1)Cl)CCCC2=CN=CC=C2

InChI

InChI=1S/C24H33ClN2O4S/c1-2-31-24(28)16-11-20(8-5-9-21-10-6-17-26-19-21)7-3-4-18-27-32(29,30)23-14-12-22(25)13-15-23/h6,10,12-15,17,19-20,27H,2-5,7-9,11,16,18H2,1H3