8-[(4-chlorophenyl)sulfonylamino]-3-(4-pyridin-3-ylbutyl)octanoic acid

Systemtic Name: 8-[(4-chlorophenyl)sulfonylamino]-3-(4-pyridin-3-ylbutyl)octanoic acid Openeye Name: 8-[(4-chlorophenyl)sulfonylamino]-3-[4-(3-pyridyl)butyl]octanoic acid CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-3-[4-(3-pyridinyl)butyl]octanoic acid IUPAC Name: 8-[(4-chlorophenyl)sulfonylamino]-3-(4-pyridin-3-ylbutyl)octanoic acid Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-3-[4-(3-pyridyl)butyl]caprylic acid Formula: C23H31ClN2O4S MolecularWeight: 467.02124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCCC(CCCCCNS(=O)(=O)C2=CC=C(C=C2)Cl)CC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCCCC(CCCCCNS(=O)(=O)C2=CC=C(C=C2)Cl)CC(=O)O

InChI

InChI=1S/C23H31ClN2O4S/c24-21-11-13-22(14-12-21)31(29,30)26-16-5-1-2-7-19(17-23(27)28)8-3-4-9-20-10-6-15-25-18-20/h6,10-15,18-19,26H,1-5,7-9,16-17H2,(H,27,28)