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

Systemtic Name: 3-[2-(5-chloranyl-2-phenylmethoxy-phenyl)phenyl]-5-(2-methylpropanoylamino)benzoic acid Openeye Name: 3-[2-(2-benzyloxy-5-chloro-phenyl)phenyl]-5-(2-methylpropanoylamino)benzoic acid CAS Name: 3-[2-(5-chloro-2-phenylmethoxyphenyl)phenyl]-5-[(2-methyl-1-oxopropyl)amino]benzoic acid IUPAC Name: 3-[2-(5-chloro-2-phenylmethoxyphenyl)phenyl]-5-(2-methylpropanoylamino)benzoic acid Traditional Name: 3-[2-(2-benzoxy-5-chloro-phenyl)phenyl]-5-(isobutyrylamino)benzoic acid Formula: C30H26ClNO4 MolecularWeight: 499.98474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H26ClNO4/c1-19(2)29(33)32-24-15-21(14-22(16-24)30(34)35)25-10-6-7-11-26(25)27-17-23(31)12-13-28(27)36-18-20-8-4-3-5-9-20/h3-17,19H,18H2,1-2H3,(H,32,33)(H,34,35)