5-methyl-3-[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]hexanoic acid

Systemtic Name: 5-methyl-3-[[1-(3-piperidin-4-ylpropanoyl)piperidin-3-yl]carbonylamino]hexanoic acid Openeye Name: 5-methyl-3-[[1-[3-(4-piperidyl)propanoyl]piperidine-3-carbonyl]amino]hexanoic acid CAS Name: 5-methyl-3-[[oxo-[1-[1-oxo-3-(4-piperidinyl)propyl]-3-piperidinyl]methyl]amino]hexanoic acid IUPAC Name: 5-methyl-3-[[1-(3-piperidin-4-ylpropanoyl)piperidine-3-carbonyl]amino]hexanoic acid Traditional Name: 5-methyl-3-[[1-[3-(4-piperidyl)propanoyl]nipecotoyl]amino]hexanoic acid Formula: C21H37N3O4 MolecularWeight: 395.53618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)O)NC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2

Isomeric SMILES

CC(C)CC(CC(=O)O)NC(=O)C1CCCN(C1)C(=O)CCC2CCNCC2

InChI

InChI=1S/C21H37N3O4/c1-15(2)12-18(13-20(26)27)23-21(28)17-4-3-11-24(14-17)19(25)6-5-16-7-9-22-10-8-16/h15-18,22H,3-14H2,1-2H3,(H,23,28)(H,26,27)