ethyl (Z)-5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-4-(4-methylpyridin-1-ium-1-yl)-5-methylsulfanyl-3-oxidanylidene-pent-4-enoate

Systemtic Name: ethyl (Z)-5-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-4-(4-methylpyridin-1-ium-1-yl)-5-methylsulfanyl-3-oxidanylidene-pent-4-enoate Openeye Name: ethyl (Z)-5-(2-ethoxy-2-oxo-ethyl)sulfanyl-4-(4-methylpyridin-1-ium-1-yl)-5-methylsulfanyl-3-oxo-pent-4-enoate CAS Name: (Z)-5-[(2-ethoxy-2-oxoethyl)thio]-4-(4-methyl-1-pyridin-1-iumyl)-5-(methylthio)-3-oxo-4-pentenoic acid ethyl ester IUPAC Name: ethyl (Z)-5-(2-ethoxy-2-oxoethyl)sulfanyl-4-(4-methylpyridin-1-ium-1-yl)-5-methylsulfanyl-3-oxopent-4-enoate Traditional Name: (Z)-5-[(2-ethoxy-2-keto-ethyl)thio]-3-keto-4-(4-methylpyridin-1-ium-1-yl)-5-(methylthio)pent-4-enoic acid ethyl ester Formula: C18H24NO5S2+ MolecularWeight: 398.51686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C(=C(SC)SCC(=O)OCC)[N+]1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)CC(=O)/C(=C(\SC)/SCC(=O)OCC)/[N+]1=CC=C(C=C1)C

InChI

InChI=1S/C18H24NO5S2/c1-5-23-15(21)11-14(20)17(19-9-7-13(3)8-10-19)18(25-4)26-12-16(22)24-6-2/h7-10H,5-6,11-12H2,1-4H3/q+1/b18-17-