[4-[(E)-3-oxidanylideneprop-1-enyl]cyclohexyl] 4-cyanobenzoate

Systemtic Name: [4-[(E)-3-oxidanylideneprop-1-enyl]cyclohexyl] 4-cyanobenzoate Openeye Name: [4-[(E)-3-oxoprop-1-enyl]cyclohexyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [4-[(E)-3-oxoprop-1-enyl]cyclohexyl] ester IUPAC Name: [4-[(E)-3-oxoprop-1-enyl]cyclohexyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [4-[(E)-3-ketoprop-1-enyl]cyclohexyl] ester Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C=CC=O)OC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CC(CCC1/C=C/C=O)OC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H17NO3/c18-12-14-3-7-15(8-4-14)17(20)21-16-9-5-13(6-10-16)2-1-11-19/h1-4,7-8,11,13,16H,5-6,9-10H2/b2-1+