[(1S)-2-oxidanylidenecyclohexyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [(1S)-2-oxocyclohexyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methoxyphenyl)-2-propenoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-methoxyphenyl)acrylic acid [(1S)-2-ketocyclohexyl] ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C(=O)OC2CCCCC2=O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)O[C@H]2CCCCC2=O

InChI

InChI=1S/C17H17NO4/c1-21-14-8-6-12(7-9-14)10-13(11-18)17(20)22-16-5-3-2-4-15(16)19/h6-10,16H,2-5H2,1H3/b13-10+/t16-/m0/s1