3-oxidanyl-2-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]butanoic acid

Systemtic Name: 3-oxidanyl-2-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]butanoic acid Openeye Name: 3-hydroxy-2-[[2-(2-oxoazepan-1-yl)acetyl]amino]butanoic acid CAS Name: 3-hydroxy-2-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[[2-(2-oxoazepan-1-yl)acetyl]amino]butanoic acid Traditional Name: 3-hydroxy-2-[[2-(2-ketoazepan-1-yl)acetyl]amino]butyric acid Formula: C12H20N2O5 MolecularWeight: 272.2976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)CN1CCCCCC1=O)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)CN1CCCCCC1=O)O

InChI

InChI=1S/C12H20N2O5/c1-8(15)11(12(18)19)13-9(16)7-14-6-4-2-3-5-10(14)17/h8,11,15H,2-7H2,1H3,(H,13,16)(H,18,19)