3-methyl-2-[[4-oxidanyl-4-oxidanylidene-2-[(1-piperidin-4-ylcarbonylpiperidin-2-yl)carbonylamino]butanoyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[4-oxidanyl-4-oxidanylidene-2-[(1-piperidin-4-ylcarbonylpiperidin-2-yl)carbonylamino]butanoyl]amino]butanoic acid Openeye Name: 2-[[4-hydroxy-4-oxo-2-[[1-(piperidine-4-carbonyl)piperidine-2-carbonyl]amino]butanoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[4-hydroxy-1,4-dioxo-2-[[oxo-[1-[oxo(4-piperidinyl)methyl]-2-piperidinyl]methyl]amino]butyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[4-hydroxy-4-oxo-2-[[1-(piperidine-4-carbonyl)piperidine-2-carbonyl]amino]butanoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[4-hydroxy-2-[(1-isonipecotoylpipecoloyl)amino]-4-keto-butanoyl]amino]-3-methyl-butyric acid Formula: C21H34N4O7 MolecularWeight: 454.51726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C1CCCCN1C(=O)C2CCNCC2

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C1CCCCN1C(=O)C2CCNCC2

InChI

InChI=1S/C21H34N4O7/c1-12(2)17(21(31)32)24-18(28)14(11-16(26)27)23-19(29)15-5-3-4-10-25(15)20(30)13-6-8-22-9-7-13/h12-15,17,22H,3-11H2,1-2H3,(H,23,29)(H,24,28)(H,26,27)(H,31,32)