ethyl 3-cyano-4-(2-methylpropyl)benzoate

Systemtic Name: ethyl 3-cyano-4-(2-methylpropyl)benzoate Openeye Name: ethyl 3-cyano-4-isobutyl-benzoate CAS Name: 3-cyano-4-(2-methylpropyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-cyano-4-(2-methylpropyl)benzoate Traditional Name: 3-cyano-4-isobutyl-benzoic acid ethyl ester Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)CC(C)C)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)CC(C)C)C#N

InChI

InChI=1S/C14H17NO2/c1-4-17-14(16)12-6-5-11(7-10(2)3)13(8-12)9-15/h5-6,8,10H,4,7H2,1-3H3