(4-propan-2-ylphenyl)methyl 3-cyanobenzoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 3-cyanobenzoate Openeye Name: (4-isopropylphenyl)methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (4-isopropylbenzyl) ester Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C18H17NO2/c1-13(2)16-8-6-14(7-9-16)12-21-18(20)17-5-3-4-15(10-17)11-19/h3-10,13H,12H2,1-2H3