methyl 4-[3-(3-chloranylphenoxy)-5-nitro-phenoxy]benzoate

Systemtic Name: methyl 4-[3-(3-chloranylphenoxy)-5-nitro-phenoxy]benzoate Openeye Name: methyl 4-[3-(3-chlorophenoxy)-5-nitro-phenoxy]benzoate CAS Name: 4-[3-(3-chlorophenoxy)-5-nitrophenoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(3-chlorophenoxy)-5-nitrophenoxy]benzoate Traditional Name: 4-[3-(3-chlorophenoxy)-5-nitro-phenoxy]benzoic acid methyl ester Formula: C20H14ClNO6 MolecularWeight: 399.78126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])OC3=CC(=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])OC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H14ClNO6/c1-26-20(23)13-5-7-16(8-6-13)27-18-10-15(22(24)25)11-19(12-18)28-17-4-2-3-14(21)9-17/h2-12H,1H3