methyl 3-nitro-4-[2-oxidanylidene-2-(4-phenylphenyl)ethoxy]benzoate

Systemtic Name: methyl 3-nitro-4-[2-oxidanylidene-2-(4-phenylphenyl)ethoxy]benzoate Openeye Name: methyl 3-nitro-4-[2-oxo-2-(4-phenylphenyl)ethoxy]benzoate CAS Name: 3-nitro-4-[2-oxo-2-(4-phenylphenyl)ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-[2-oxo-2-(4-phenylphenyl)ethoxy]benzoate Traditional Name: 4-[2-keto-2-(4-phenylphenyl)ethoxy]-3-nitro-benzoic acid methyl ester Formula: C22H17NO6 MolecularWeight: 391.37348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H17NO6/c1-28-22(25)18-11-12-21(19(13-18)23(26)27)29-14-20(24)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-13H,14H2,1H3