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

Systemtic Name: 3-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]propanoic acid Openeye Name: 3-[[2-(2-oxoazepan-1-yl)acetyl]amino]propanoic acid CAS Name: 3-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]amino]propanoic acid IUPAC Name: 3-[[2-(2-oxoazepan-1-yl)acetyl]amino]propanoic acid Traditional Name: 3-[[2-(2-ketoazepan-1-yl)acetyl]amino]propionic acid Formula: C11H18N2O4 MolecularWeight: 242.27162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)NCCC(=O)O

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)NCCC(=O)O

InChI

InChI=1S/C11H18N2O4/c14-9(12-6-5-11(16)17)8-13-7-3-1-2-4-10(13)15/h1-8H2,(H,12,14)(H,16,17)