methyl 2,6-bis(cyanomethyl)benzoate

Systemtic Name: methyl 2,6-bis(cyanomethyl)benzoate Openeye Name: methyl 2,6-bis(cyanomethyl)benzoate CAS Name: 2,6-bis(cyanomethyl)benzoic acid methyl ester IUPAC Name: methyl 2,6-bis(cyanomethyl)benzoate Traditional Name: 2,6-bis(cyanomethyl)benzoic acid methyl ester Formula: C12H10N2O2 MolecularWeight: 214.22

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1CC#N)CC#N

Isomeric SMILES

COC(=O)C1=C(C=CC=C1CC#N)CC#N

InChI

InChI=1S/C12H10N2O2/c1-16-12(15)11-9(5-7-13)3-2-4-10(11)6-8-14/h2-4H,5-6H2,1H3