[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate CAS Name: 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Traditional Name: 4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoic acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C29H20F3NO7 MolecularWeight: 551.46681

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)OC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=CC=C(C=C3)OC4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C29H20F3NO7/c30-29(31,32)22-10-15-27(25(16-22)33(36)37)40-24-13-8-21(9-14-24)28(35)39-18-26(34)20-6-11-23(12-7-20)38-17-19-4-2-1-3-5-19/h1-16H,17-18H2