8-[(4-chlorophenyl)sulfonylamino]-2,2-dimethyl-4-(3-pyridin-3-ylpropyl)octanoic acid

Systemtic Name: 8-[(4-chlorophenyl)sulfonylamino]-2,2-dimethyl-4-(3-pyridin-3-ylpropyl)octanoic acid Openeye Name: 8-[(4-chlorophenyl)sulfonylamino]-2,2-dimethyl-4-[3-(3-pyridyl)propyl]octanoic acid CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-2,2-dimethyl-4-[3-(3-pyridinyl)propyl]octanoic acid IUPAC Name: 8-[(4-chlorophenyl)sulfonylamino]-2,2-dimethyl-4-(3-pyridin-3-ylpropyl)octanoic acid Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-2,2-dimethyl-4-[3-(3-pyridyl)propyl]caprylic acid Formula: C24H33ClN2O4S MolecularWeight: 481.04782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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