(4-methoxycarbonylphenyl) 3-cyanobenzoate

Systemtic Name: (4-methoxycarbonylphenyl) 3-cyanobenzoate Openeye Name: (4-methoxycarbonylphenyl) 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid (4-carbomethoxyphenyl) ester Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11NO4/c1-20-15(18)12-5-7-14(8-6-12)21-16(19)13-4-2-3-11(9-13)10-17/h2-9H,1H3