1-(2-methoxy-2-oxidanylidene-ethyl)azepane-3-carboxylic acid

Systemtic Name: 1-(2-methoxy-2-oxidanylidene-ethyl)azepane-3-carboxylic acid Openeye Name: 1-(2-methoxy-2-oxo-ethyl)azepane-3-carboxylic acid CAS Name: 1-(2-methoxy-2-oxoethyl)-3-azepanecarboxylic acid IUPAC Name: 1-(2-methoxy-2-oxoethyl)azepane-3-carboxylic acid Traditional Name: 1-(2-keto-2-methoxy-ethyl)azepane-3-carboxylic acid Formula: C10H17NO4 MolecularWeight: 215.24628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCCCC(C1)C(=O)O

Isomeric SMILES

COC(=O)CN1CCCCC(C1)C(=O)O

InChI

InChI=1S/C10H17NO4/c1-15-9(12)7-11-5-3-2-4-8(6-11)10(13)14/h8H,2-7H2,1H3,(H,13,14)