8-[(4-chlorophenyl)sulfonylamino]-4-[3-(4-methylpyridin-3-yl)propyl]octanoic acid

Systemtic Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(4-methylpyridin-3-yl)propyl]octanoic acid Openeye Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(4-methyl-3-pyridyl)propyl]octanoic acid CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(4-methyl-3-pyridinyl)propyl]octanoic acid IUPAC Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(4-methylpyridin-3-yl)propyl]octanoic acid Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[3-(4-methyl-3-pyridyl)propyl]caprylic acid Formula: C23H31ClN2O4S MolecularWeight: 467.02124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NC=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)Cl)CCC(=O)O

Isomeric SMILES

CC1=C(C=NC=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)Cl)CCC(=O)O

InChI

InChI=1S/C23H31ClN2O4S/c1-18-14-16-25-17-20(18)7-4-6-19(8-13-23(27)28)5-2-3-15-26-31(29,30)22-11-9-21(24)10-12-22/h9-12,14,16-17,19,26H,2-8,13,15H2,1H3,(H,27,28)