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

Systemtic Name: (4-cyano-2-methoxy-phenyl) 2-chloranyl-4-nitro-benzoate Openeye Name: (4-cyano-2-methoxy-phenyl) 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (4-cyano-2-methoxy-phenyl) ester Formula: C15H9ClN2O5 MolecularWeight: 332.69536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9ClN2O5/c1-22-14-6-9(8-17)2-5-13(14)23-15(19)11-4-3-10(18(20)21)7-12(11)16/h2-7H,1H3