methyl (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxidanylidene-butan-2-yl)-5-methyl-pyridin-2-ylidene]but-2-enoate

Systemtic Name: methyl (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxidanylidene-butan-2-yl)-5-methyl-pyridin-2-ylidene]but-2-enoate Openeye Name: methyl (E,4E)-2-cyano-4-[1-(1-ethoxycarbonylpropyl)-5-methyl-2-pyridylidene]but-2-enoate CAS Name: (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxobutan-2-yl)-5-methyl-2-pyridinylidene]-2-butenoic acid methyl ester IUPAC Name: methyl (E,4E)-2-cyano-4-[1-(1-ethoxy-1-oxobutan-2-yl)-5-methylpyridin-2-ylidene]but-2-enoate Traditional Name: (E,4E)-4-[1-(1-carbethoxypropyl)-5-methyl-2-pyridylidene]-2-cyano-but-2-enoic acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C=C(C=CC1=CC=C(C#N)C(=O)OC)C

Isomeric SMILES

CCC(C(=O)OCC)N\1C=C(C=C/C1=C\C=C(/C#N)\C(=O)OC)C

InChI

InChI=1S/C18H22N2O4/c1-5-16(18(22)24-6-2)20-12-13(3)7-9-15(20)10-8-14(11-19)17(21)23-4/h7-10,12,16H,5-6H2,1-4H3/b14-8+,15-10+