ethyl (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxidanylidene-propan-2-yl)pyridin-2-ylidene]but-2-enoate

Systemtic Name: ethyl (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxidanylidene-propan-2-yl)pyridin-2-ylidene]but-2-enoate Openeye Name: ethyl (E,4E)-2-cyano-4-[1-(2-ethoxy-1-methyl-2-oxo-ethyl)-2-pyridylidene]but-2-enoate CAS Name: (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxopropan-2-yl)-2-pyridinylidene]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxopropan-2-yl)pyridin-2-ylidene]but-2-enoate Traditional Name: (E,4E)-2-cyano-4-[1-(2-ethoxy-2-keto-1-methyl-ethyl)-2-pyridylidene]but-2-enoic acid ethyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N1C=CC=CC1=CC=C(C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C)N\1C=CC=C/C1=C\C=C(/C#N)\C(=O)OCC

InChI

InChI=1S/C17H20N2O4/c1-4-22-16(20)13(3)19-11-7-6-8-15(19)10-9-14(12-18)17(21)23-5-2/h6-11,13H,4-5H2,1-3H3/b14-9+,15-10+