2-[[4-(2-methoxyethanoylamino)-1-piperidin-4-ylcarbonyl-piperidin-2-yl]carbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[4-(2-methoxyethanoylamino)-1-piperidin-4-ylcarbonyl-piperidin-2-yl]carbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[4-[(2-methoxyacetyl)amino]-1-(piperidine-4-carbonyl)piperidine-2-carbonyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[[4-[(2-methoxy-1-oxoethyl)amino]-1-[oxo(4-piperidinyl)methyl]-2-piperidinyl]-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[4-[(2-methoxyacetyl)amino]-1-(piperidine-4-carbonyl)piperidine-2-carbonyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[1-isonipecotoyl-4-[(2-methoxyacetyl)amino]pipecoloyl]amino]-4-methyl-valeric acid Formula: C21H36N4O6 MolecularWeight: 440.53374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C1CC(CCN1C(=O)C2CCNCC2)NC(=O)COC

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C1CC(CCN1C(=O)C2CCNCC2)NC(=O)COC

InChI

InChI=1S/C21H36N4O6/c1-13(2)10-16(21(29)30)24-19(27)17-11-15(23-18(26)12-31-3)6-9-25(17)20(28)14-4-7-22-8-5-14/h13-17,22H,4-12H2,1-3H3,(H,23,26)(H,24,27)(H,29,30)