8-[(3,4-dichlorophenyl)sulfonylamino]-7-pyridin-3-yl-octanoic acid hydrochloride

Systemtic Name: 8-[(3,4-dichlorophenyl)sulfonylamino]-7-pyridin-3-yl-octanoic acid hydrochloride Openeye Name: 8-[(3,4-dichlorophenyl)sulfonylamino]-7-(3-pyridyl)octanoic acid hydrochloride CAS Name: 8-[(3,4-dichlorophenyl)sulfonylamino]-7-(3-pyridinyl)octanoic acid hydrochloride IUPAC Name: 8-[(3,4-dichlorophenyl)sulfonylamino]-7-pyridin-3-yloctanoic acid hydrochloride Traditional Name: 8-[(3,4-dichlorophenyl)sulfonylamino]-7-(3-pyridyl)caprylic acid hydrochloride Formula: C19H23Cl3N2O4S MolecularWeight: 481.82092

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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)Cl.Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H22Cl2N2O4S.ClH/c20-17-9-8-16(11-18(17)21)28(26,27)23-13-15(14-6-4-10-22-12-14)5-2-1-3-7-19(24)25;/h4,6,8-12,15,23H,1-3,5,7,13H2,(H,24,25);1H