3-methyl-2-[[3-methyl-2-(methylsulfonylamino)pentyl]-piperidin-2-ylcarbonyl-amino]pentanoic acid

Systemtic Name: 3-methyl-2-[[3-methyl-2-(methylsulfonylamino)pentyl]-piperidin-2-ylcarbonyl-amino]pentanoic acid Openeye Name: 2-[[2-(methanesulfonamido)-3-methyl-pentyl]-(piperidine-2-carbonyl)amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-(methanesulfonamido)-3-methylpentyl]-[oxo(2-piperidinyl)methyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-(methanesulfonamido)-3-methylpentyl]-(piperidine-2-carbonyl)amino]-3-methylpentanoic acid Traditional Name: 2-[[2-(methanesulfonamido)-3-methyl-pentyl]-pipecoloyl-amino]-3-methyl-valeric acid Formula: C19H37N3O5S MolecularWeight: 419.57918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CN(C(C(C)CC)C(=O)O)C(=O)C1CCCCN1)NS(=O)(=O)C

Isomeric SMILES

CCC(C)C(CN(C(C(C)CC)C(=O)O)C(=O)C1CCCCN1)NS(=O)(=O)C

InChI

InChI=1S/C19H37N3O5S/c1-6-13(3)16(21-28(5,26)27)12-22(17(19(24)25)14(4)7-2)18(23)15-10-8-9-11-20-15/h13-17,20-21H,6-12H2,1-5H3,(H,24,25)