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

Systemtic Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(4-pyridin-3-ylphenyl)octanoic acid Openeye Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[4-(3-pyridyl)phenyl]octanoic acid CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[4-(3-pyridinyl)phenyl]octanoic acid IUPAC Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(4-pyridin-3-ylphenyl)octanoic acid Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[4-(3-pyridyl)phenyl]caprylic acid Formula: C25H27ClN2O4S MolecularWeight: 487.01088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=CC=C(C=C2)C(CCCCNS(=O)(=O)C3=CC=C(C=C3)Cl)CCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C2=CC=C(C=C2)C(CCCCNS(=O)(=O)C3=CC=C(C=C3)Cl)CCC(=O)O

InChI

InChI=1S/C25H27ClN2O4S/c26-23-11-13-24(14-12-23)33(31,32)28-17-2-1-4-19(10-15-25(29)30)20-6-8-21(9-7-20)22-5-3-16-27-18-22/h3,5-9,11-14,16,18-19,28H,1-2,4,10,15,17H2,(H,29,30)