[5-(cyanomethoxy)-2-ethanoyl-phenyl] benzoate

Systemtic Name: [5-(cyanomethoxy)-2-ethanoyl-phenyl] benzoate Openeye Name: [2-acetyl-5-(cyanomethoxy)phenyl] benzoate CAS Name: benzoic acid [2-acetyl-5-(cyanomethoxy)phenyl] ester IUPAC Name: [2-acetyl-5-(cyanomethoxy)phenyl] benzoate Traditional Name: benzoic acid [2-acetyl-5-(cyanomethoxy)phenyl] ester Formula: C17H13NO4 MolecularWeight: 295.28942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCC#N)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCC#N)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H13NO4/c1-12(19)15-8-7-14(21-10-9-18)11-16(15)22-17(20)13-5-3-2-4-6-13/h2-8,11H,10H2,1H3