methyl 3,5-bis(2-cyanopropan-2-yl)benzoate

Systemtic Name: methyl 3,5-bis(2-cyanopropan-2-yl)benzoate Openeye Name: methyl 3,5-bis(1-cyano-1-methyl-ethyl)benzoate CAS Name: 3,5-bis(2-cyanopropan-2-yl)benzoic acid methyl ester IUPAC Name: methyl 3,5-bis(2-cyanopropan-2-yl)benzoate Traditional Name: 3,5-bis(1-cyano-1-methyl-ethyl)benzoic acid methyl ester Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O2/c1-15(2,9-17)12-6-11(14(19)20-5)7-13(8-12)16(3,4)10-18/h6-8H,1-5H3