1-(2-cyanophenyl)heptyl benzoate

Systemtic Name: 1-(2-cyanophenyl)heptyl benzoate Openeye Name: 1-(2-cyanophenyl)heptyl benzoate CAS Name: benzoic acid 1-(2-cyanophenyl)heptyl ester IUPAC Name: 1-(2-cyanophenyl)heptyl benzoate Traditional Name: benzoic acid 1-(2-cyanophenyl)heptyl ester Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=CC=C1C#N)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC(C1=CC=CC=C1C#N)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO2/c1-2-3-4-8-15-20(19-14-10-9-13-18(19)16-22)24-21(23)17-11-6-5-7-12-17/h5-7,9-14,20H,2-4,8,15H2,1H3