(4-cyano-2-methoxy-phenyl) 4-methoxy-3-nitro-benzoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 4-methoxy-3-nitro-benzoate Openeye Name: (4-cyano-2-methoxy-phenyl) 4-methoxy-3-nitro-benzoate CAS Name: 4-methoxy-3-nitrobenzoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 4-methoxy-3-nitrobenzoate Traditional Name: 4-methoxy-3-nitro-benzoic acid (4-cyano-2-methoxy-phenyl) ester Formula: C16H12N2O6 MolecularWeight: 328.27628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C#N)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2=C(C=C(C=C2)C#N)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O6/c1-22-13-6-4-11(8-12(13)18(20)21)16(19)24-14-5-3-10(9-17)7-15(14)23-2/h3-8H,1-2H3