ethyl 1-[2-(cyanomethylamino)-2-oxidanylidene-ethanoyl]piperidine-2-carboxylate

Systemtic Name: ethyl 1-[2-(cyanomethylamino)-2-oxidanylidene-ethanoyl]piperidine-2-carboxylate Openeye Name: ethyl 1-[2-(cyanomethylamino)-2-oxo-acetyl]piperidine-2-carboxylate CAS Name: 1-[2-(cyanomethylamino)-1,2-dioxoethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(cyanomethylamino)-2-oxoacetyl]piperidine-2-carboxylate Traditional Name: 1-[2-(cyanomethylamino)-2-keto-acetyl]pipecolinic acid ethyl ester Formula: C12H17N3O4 MolecularWeight: 267.28108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C(=O)NCC#N

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)C(=O)NCC#N

InChI

InChI=1S/C12H17N3O4/c1-2-19-12(18)9-5-3-4-8-15(9)11(17)10(16)14-7-6-13/h9H,2-5,7-8H2,1H3,(H,14,16)