methyl 1-[2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-cyano-3-(2-furylmethylamino)-3-oxo-prop-1-enyl]piperidine-4-carboxylate CAS Name: 1-[2-cyano-3-(2-furanylmethylamino)-3-oxoprop-1-enyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-cyano-3-(furan-2-ylmethylamino)-3-oxoprop-1-enyl]piperidine-4-carboxylate Traditional Name: 1-[2-cyano-3-(2-furfurylamino)-3-keto-prop-1-enyl]isonipecotic acid methyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C=C(C#N)C(=O)NCC2=CC=CO2

Isomeric SMILES

COC(=O)C1CCN(CC1)C=C(C#N)C(=O)NCC2=CC=CO2

InChI

InChI=1S/C16H19N3O4/c1-22-16(21)12-4-6-19(7-5-12)11-13(9-17)15(20)18-10-14-3-2-8-23-14/h2-3,8,11-12H,4-7,10H2,1H3,(H,18,20)