ethyl 1-[3-[(1R)-1-cyano-2-oxidanylidene-2-prop-2-enoxy-ethyl]quinoxalin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[(1R)-1-cyano-2-oxidanylidene-2-prop-2-enoxy-ethyl]quinoxalin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(1R)-2-allyloxy-1-cyano-2-oxo-ethyl]quinoxalin-2-yl]piperidine-4-carboxylate CAS Name: 1-[3-[(1R)-1-cyano-2-oxo-2-prop-2-enoxyethyl]-2-quinoxalinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(1R)-1-cyano-2-oxo-2-prop-2-enoxyethyl]quinoxalin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[(1R)-2-allyloxy-1-cyano-2-keto-ethyl]quinoxalin-2-yl]isonipecotic acid ethyl ester Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)OCC=C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3N=C2[C@H](C#N)C(=O)OCC=C

InChI

InChI=1S/C22H24N4O4/c1-3-13-30-22(28)16(14-23)19-20(25-18-8-6-5-7-17(18)24-19)26-11-9-15(10-12-26)21(27)29-4-2/h3,5-8,15-16H,1,4,9-13H2,2H3/t16-/m0/s1