methyl 3-(2-cyanocyclopenten-1-yl)benzoate

Systemtic Name: methyl 3-(2-cyanocyclopenten-1-yl)benzoate Openeye Name: methyl 3-(2-cyanocyclopenten-1-yl)benzoate CAS Name: 3-(2-cyano-1-cyclopentenyl)benzoic acid methyl ester IUPAC Name: methyl 3-(2-cyanocyclopenten-1-yl)benzoate Traditional Name: 3-(2-cyanocyclopenten-1-yl)benzoic acid methyl ester Formula: C14H13NO2 MolecularWeight: 227.25852

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C2=C(CCC2)C#N

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C2=C(CCC2)C#N

InChI

InChI=1S/C14H13NO2/c1-17-14(16)11-5-2-4-10(8-11)13-7-3-6-12(13)9-15/h2,4-5,8H,3,6-7H2,1H3