(4-cyanophenyl)methyl 3-methylbenzoate

Systemtic Name: (4-cyanophenyl)methyl 3-methylbenzoate Openeye Name: (4-cyanophenyl)methyl 3-methylbenzoate CAS Name: 3-methylbenzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid (4-cyanobenzyl) ester Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO2/c1-12-3-2-4-15(9-12)16(18)19-11-14-7-5-13(10-17)6-8-14/h2-9H,11H2,1H3