8-[(4-chlorophenyl)sulfonylamino]-7-pyridin-3-yl-octanoic acid

Systemtic Name: 8-[(4-chlorophenyl)sulfonylamino]-7-pyridin-3-yl-octanoic acid Openeye Name: 8-[(4-chlorophenyl)sulfonylamino]-7-(3-pyridyl)octanoic acid CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-7-(3-pyridinyl)octanoic acid IUPAC Name: 8-[(4-chlorophenyl)sulfonylamino]-7-pyridin-3-yloctanoic acid Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-7-(3-pyridyl)caprylic acid Formula: C19H23ClN2O4S MolecularWeight: 410.91492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CCCCCC(=O)O)CNS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CN=C1)C(CCCCCC(=O)O)CNS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H23ClN2O4S/c20-17-8-10-18(11-9-17)27(25,26)22-14-16(15-6-4-12-21-13-15)5-2-1-3-7-19(23)24/h4,6,8-13,16,22H,1-3,5,7,14H2,(H,23,24)