propyl 3-cyanobenzoate

Systemtic Name: propyl 3-cyanobenzoate Openeye Name: propyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid propyl ester IUPAC Name: propyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid propyl ester Formula: C11H11NO2 MolecularWeight: 189.21054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO2/c1-2-6-14-11(13)10-5-3-4-9(7-10)8-12/h3-5,7H,2,6H2,1H3