ethyl (E)-2-cyano-3-[(1Z)-2-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)cycloocten-1-yl]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(1Z)-2-(1-cyano-2-ethoxy-2-oxidanylidene-ethyl)cycloocten-1-yl]-3-methylsulfanyl-prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[(1Z)-2-(1-cyano-2-ethoxy-2-oxo-ethyl)cycloocten-1-yl]-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-[(1Z)-2-(1-cyano-2-ethoxy-2-oxoethyl)-1-cyclooctenyl]-3-(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[(1Z)-2-(1-cyano-2-ethoxy-2-oxoethyl)cycloocten-1-yl]-3-methylsulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-[(1Z)-2-(1-cyano-2-ethoxy-2-keto-ethyl)cycloocten-1-yl]-3-(methylthio)acrylic acid ethyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=C(CCCCCC1)C(=C(C#N)C(=O)OCC)SC

Isomeric SMILES

CCOC(=O)C(C#N)/C/1=C(/CCCCCC1)\C(=C(\C#N)/C(=O)OCC)\SC

InChI

InChI=1S/C20H26N2O4S/c1-4-25-19(23)16(12-21)14-10-8-6-7-9-11-15(14)18(27-3)17(13-22)20(24)26-5-2/h16H,4-11H2,1-3H3/b15-14-,18-17+