methyl 2-cyano-3-(4-propylphenyl)propanoate

Systemtic Name: methyl 2-cyano-3-(4-propylphenyl)propanoate Openeye Name: methyl 2-cyano-3-(4-propylphenyl)propanoate CAS Name: 2-cyano-3-(4-propylphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-(4-propylphenyl)propanoate Traditional Name: 2-cyano-3-(4-propylphenyl)propionic acid methyl ester Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)CC(C#N)C(=O)OC

Isomeric SMILES

CCCC1=CC=C(C=C1)CC(C#N)C(=O)OC

InChI

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