2-[[4-(4-chlorophenyl)carbonylpiperidin-1-yl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[4-(4-chlorophenyl)carbonylpiperidin-1-yl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[[4-(4-chlorobenzoyl)-1-piperidyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[[4-[(4-chlorophenyl)-oxomethyl]-1-piperidinyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[[4-(4-chlorobenzoyl)piperidin-1-yl]sulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[[4-(4-chlorobenzoyl)piperidino]sulfonylamino]-3-methyl-butyric acid Formula: C17H23ClN2O5S MolecularWeight: 402.89292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)N1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)N1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H23ClN2O5S/c1-11(2)15(17(22)23)19-26(24,25)20-9-7-13(8-10-20)16(21)12-3-5-14(18)6-4-12/h3-6,11,13,15,19H,7-10H2,1-2H3,(H,22,23)