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

Systemtic Name: ethyl 1-[3-(1-cyano-2-methoxy-2-oxidanylidene-ethyl)quinoxalin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(1-cyano-2-methoxy-2-oxo-ethyl)quinoxalin-2-yl]piperidine-4-carboxylate CAS Name: 1-[3-(1-cyano-2-methoxy-2-oxoethyl)-2-quinoxalinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1-cyano-2-methoxy-2-oxoethyl)quinoxalin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-(1-cyano-2-keto-2-methoxy-ethyl)quinoxalin-2-yl]isonipecotic acid ethyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O4/c1-3-28-19(25)13-8-10-24(11-9-13)18-17(14(12-21)20(26)27-2)22-15-6-4-5-7-16(15)23-18/h4-7,13-14H,3,8-11H2,1-2H3