ethyl 2-(cyanomethyl)-3-methoxy-benzoate

Systemtic Name: ethyl 2-(cyanomethyl)-3-methoxy-benzoate Openeye Name: ethyl 2-(cyanomethyl)-3-methoxy-benzoate CAS Name: 2-(cyanomethyl)-3-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 2-(cyanomethyl)-3-methoxybenzoate Traditional Name: 2-(cyanomethyl)-3-methoxy-benzoic acid ethyl ester Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c1-3-16-12(14)10-5-4-6-11(15-2)9(10)7-8-13/h4-6H,3,7H2,1-2H3