3-acetamido-5-[2-(5-chloranyl-2-phenylmethoxy-phenyl)phenyl]benzoic acid

Systemtic Name: 3-acetamido-5-[2-(5-chloranyl-2-phenylmethoxy-phenyl)phenyl]benzoic acid Openeye Name: 3-acetamido-5-[2-(2-benzyloxy-5-chloro-phenyl)phenyl]benzoic acid CAS Name: 3-acetamido-5-[2-(5-chloro-2-phenylmethoxyphenyl)phenyl]benzoic acid IUPAC Name: 3-acetamido-5-[2-(5-chloro-2-phenylmethoxyphenyl)phenyl]benzoic acid Traditional Name: 3-acetamido-5-[2-(2-benzoxy-5-chloro-phenyl)phenyl]benzoic acid Formula: C28H22ClNO4 MolecularWeight: 471.93158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H22ClNO4/c1-18(31)30-23-14-20(13-21(15-23)28(32)33)24-9-5-6-10-25(24)26-16-22(29)11-12-27(26)34-17-19-7-3-2-4-8-19/h2-16H,17H2,1H3,(H,30,31)(H,32,33)