3-cyanopropyl benzoate

Systemtic Name: 3-cyanopropyl benzoate Openeye Name: 3-cyanopropyl benzoate CAS Name: benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl benzoate Traditional Name: benzoic acid 3-cyanopropyl ester Formula: C11H11NO2 MolecularWeight: 189.21054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO2/c12-8-4-5-9-14-11(13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,9H2