4-acetamido-2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid

Systemtic Name: 4-acetamido-2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid Openeye Name: 4-acetamido-2-[2-[2-benzyloxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid CAS Name: 4-acetamido-2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid IUPAC Name: 4-acetamido-2-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid Traditional Name: 4-acetamido-2-[2-[2-benzoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid Formula: C29H22F3NO4 MolecularWeight: 505.48449

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2C3=C(C=CC(=C3)C(F)(F)F)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2C3=C(C=CC(=C3)C(F)(F)F)OCC4=CC=CC=C4

InChI

InChI=1S/C29H22F3NO4/c1-18(34)33-21-12-13-24(28(35)36)25(16-21)22-9-5-6-10-23(22)26-15-20(29(30,31)32)11-14-27(26)37-17-19-7-3-2-4-8-19/h2-16H,17H2,1H3,(H,33,34)(H,35,36)