2-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(azepan-1-yl)-2-oxo-ethyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(azepan-1-yl)-2-oxoethyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]amino]-3-methyl-butyric acid Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(=O)N1CCCCCC1

Isomeric SMILES

CC(C)C(C(=O)O)NCC(=O)N1CCCCCC1

InChI

InChI=1S/C13H24N2O3/c1-10(2)12(13(17)18)14-9-11(16)15-7-5-3-4-6-8-15/h10,12,14H,3-9H2,1-2H3,(H,17,18)