6-(4-chlorophenyl)-2-[[methyl(methylsulfonyl)amino]methyl]-3-piperidin-1-ylcarbonyl-hexanoic acid

Systemtic Name: 6-(4-chlorophenyl)-2-[[methyl(methylsulfonyl)amino]methyl]-3-piperidin-1-ylcarbonyl-hexanoic acid Openeye Name: 6-(4-chlorophenyl)-2-[[methyl(methylsulfonyl)amino]methyl]-3-(piperidine-1-carbonyl)hexanoic acid CAS Name: 6-(4-chlorophenyl)-2-[[methyl(methylsulfonyl)amino]methyl]-3-[oxo(1-piperidinyl)methyl]hexanoic acid IUPAC Name: 6-(4-chlorophenyl)-2-[[methyl(methylsulfonyl)amino]methyl]-3-(piperidine-1-carbonyl)hexanoic acid Traditional Name: 6-(4-chlorophenyl)-2-[[mesyl(methyl)amino]methyl]-3-(piperidine-1-carbonyl)hexanoic acid Formula: C21H31ClN2O5S MolecularWeight: 458.99924

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(C(CCCC1=CC=C(C=C1)Cl)C(=O)N2CCCCC2)C(=O)O)S(=O)(=O)C

Isomeric SMILES

CN(CC(C(CCCC1=CC=C(C=C1)Cl)C(=O)N2CCCCC2)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C21H31ClN2O5S/c1-23(30(2,28)29)15-19(21(26)27)18(20(25)24-13-4-3-5-14-24)8-6-7-16-9-11-17(22)12-10-16/h9-12,18-19H,3-8,13-15H2,1-2H3,(H,26,27)