2-[[(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-piperidin-1-ylcarbonyl-hexanoic acid

Systemtic Name: 2-[[(4-chloranyl-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-piperidin-1-ylcarbonyl-hexanoic acid Openeye Name: 2-[[(4-chloro-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-(piperidine-1-carbonyl)hexanoic acid CAS Name: 2-[[(4-chloro-2,5-dimethylphenyl)sulfonyl-methylamino]methyl]-5-methyl-2-[oxo(1-piperidinyl)methyl]hexanoic acid IUPAC Name: 2-[[(4-chloro-2,5-dimethylphenyl)sulfonyl-methylamino]methyl]-5-methyl-2-(piperidine-1-carbonyl)hexanoic acid Traditional Name: 2-[[(4-chloro-2,5-dimethyl-phenyl)sulfonyl-methyl-amino]methyl]-5-methyl-2-(piperidine-1-carbonyl)hexanoic acid Formula: C23H35ClN2O5S MolecularWeight: 487.0524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N(C)CC(CCC(C)C)(C(=O)N2CCCCC2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)N(C)CC(CCC(C)C)(C(=O)N2CCCCC2)C(=O)O

InChI

InChI=1S/C23H35ClN2O5S/c1-16(2)9-10-23(22(28)29,21(27)26-11-7-6-8-12-26)15-25(5)32(30,31)20-14-17(3)19(24)13-18(20)4/h13-14,16H,6-12,15H2,1-5H3,(H,28,29)