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

Systemtic Name: (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoic acid Openeye Name: (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]octanoic acid CAS Name: (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridinyl)propyl]octanoic acid IUPAC Name: (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoic acid Traditional Name: (4R)-8-[(4-chlorophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]caprylic acid Formula: C22H29ClN2O4S MolecularWeight: 452.99466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CN=C1)CCC[C@H](CCCCNS(=O)(=O)C2=CC=C(C=C2)Cl)CCC(=O)O

InChI

InChI=1S/C22H29ClN2O4S/c23-20-10-12-21(13-11-20)30(28,29)25-16-2-1-5-18(9-14-22(26)27)6-3-7-19-8-4-15-24-17-19/h4,8,10-13,15,17-18,25H,1-3,5-7,9,14,16H2,(H,26,27)/t18-/m0/s1