3-methyl-2-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]pentanoic acid

Systemtic Name: 3-methyl-2-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]pentanoic acid Openeye Name: 3-methyl-2-[[2-(2-oxoazepan-1-yl)acetyl]amino]pentanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]amino]pentanoic acid IUPAC Name: 3-methyl-2-[[2-(2-oxoazepan-1-yl)acetyl]amino]pentanoic acid Traditional Name: 2-[[2-(2-ketoazepan-1-yl)acetyl]amino]-3-methyl-valeric acid Formula: C14H24N2O4 MolecularWeight: 284.35136

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)CN1CCCCCC1=O

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)CN1CCCCCC1=O

InChI

InChI=1S/C14H24N2O4/c1-3-10(2)13(14(19)20)15-11(17)9-16-8-6-4-5-7-12(16)18/h10,13H,3-9H2,1-2H3,(H,15,17)(H,19,20)