dimethyl 5-(2-cyano-4-nitro-phenoxy)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(2-cyano-4-nitro-phenoxy)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(2-cyano-4-nitro-phenoxy)benzene-1,3-dicarboxylate CAS Name: 5-(2-cyano-4-nitrophenoxy)benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(2-cyano-4-nitrophenoxy)benzene-1,3-dicarboxylate Traditional Name: 5-(2-cyano-4-nitro-phenoxy)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H12N2O7 MolecularWeight: 356.28638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N2O7/c1-24-16(20)10-5-11(17(21)25-2)8-14(7-10)26-15-4-3-13(19(22)23)6-12(15)9-18/h3-8H,1-2H3