ethyl 4-(cyanomethyl)-2-ethoxy-benzoate

Systemtic Name: ethyl 4-(cyanomethyl)-2-ethoxy-benzoate Openeye Name: ethyl 4-(cyanomethyl)-2-ethoxy-benzoate CAS Name: 4-(cyanomethyl)-2-ethoxybenzoic acid ethyl ester IUPAC Name: ethyl 4-(cyanomethyl)-2-ethoxybenzoate Traditional Name: 4-(cyanomethyl)-2-ethoxy-benzoic acid ethyl ester Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CC#N)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CC#N)C(=O)OCC

InChI

InChI=1S/C13H15NO3/c1-3-16-12-9-10(7-8-14)5-6-11(12)13(15)17-4-2/h5-6,9H,3-4,7H2,1-2H3