(3-nitrophenyl) 4-cyanobenzoate

Systemtic Name: (3-nitrophenyl) 4-cyanobenzoate Openeye Name: (3-nitrophenyl) 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (3-nitrophenyl) ester Formula: C14H8N2O4 MolecularWeight: 268.22432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C14H8N2O4/c15-9-10-4-6-11(7-5-10)14(17)20-13-3-1-2-12(8-13)16(18)19/h1-8H