2-oxidanylidene-2-[3-(2-oxidanylidenepropyl)azepan-1-yl]oxy-ethanoic acid

Systemtic Name: 2-oxidanylidene-2-[3-(2-oxidanylidenepropyl)azepan-1-yl]oxy-ethanoic acid Openeye Name: 2-(3-acetonylazepan-1-yl)oxy-2-oxo-acetic acid CAS Name: 2-oxo-2-[[3-(2-oxopropyl)-1-azepanyl]oxy]acetic acid IUPAC Name: 2-oxo-2-[3-(2-oxopropyl)azepan-1-yl]oxyacetic acid Traditional Name: 2-(3-acetonylazepan-1-yl)oxy-2-keto-acetic acid Formula: C11H17NO5 MolecularWeight: 243.25638

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1CCCCN(C1)OC(=O)C(=O)O

Isomeric SMILES

CC(=O)CC1CCCCN(C1)OC(=O)C(=O)O

InChI

InChI=1S/C11H17NO5/c1-8(13)6-9-4-2-3-5-12(7-9)17-11(16)10(14)15/h9H,2-7H2,1H3,(H,14,15)