4-[3-fluoranyl-5-nitro-4-[2-oxidanylidene-2-[(triphenylmethyl)amino]ethoxy]phenyl]benzoic acid

Systemtic Name: 4-[3-fluoranyl-5-nitro-4-[2-oxidanylidene-2-[(triphenylmethyl)amino]ethoxy]phenyl]benzoic acid Openeye Name: 4-[3-fluoro-5-nitro-4-[2-oxo-2-(tritylamino)ethoxy]phenyl]benzoic acid CAS Name: 4-[3-fluoro-5-nitro-4-[2-oxo-2-[(triphenylmethyl)amino]ethoxy]phenyl]benzoic acid IUPAC Name: 4-[3-fluoro-5-nitro-4-[2-oxo-2-(tritylamino)ethoxy]phenyl]benzoic acid Traditional Name: 4-[3-fluoro-4-[2-keto-2-(tritylamino)ethoxy]-5-nitro-phenyl]benzoic acid Formula: C34H25FN2O6 MolecularWeight: 576.570503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(=O)COC4=C(C=C(C=C4F)C5=CC=C(C=C5)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(=O)COC4=C(C=C(C=C4F)C5=CC=C(C=C5)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C34H25FN2O6/c35-29-20-25(23-16-18-24(19-17-23)33(39)40)21-30(37(41)42)32(29)43-22-31(38)36-34(26-10-4-1-5-11-26,27-12-6-2-7-13-27)28-14-8-3-9-15-28/h1-21H,22H2,(H,36,38)(H,39,40)