3-[4-(5-chloranyl-2-methoxy-phenyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[4-(5-chloranyl-2-methoxy-phenyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[4-(5-chloro-2-methoxy-phenyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]benzoyl]amino]propanoic acid CAS Name: 3-[4-(5-chloro-2-methoxyphenyl)phenyl]-2-[[oxo-[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[4-(5-chloro-2-methoxyphenyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]benzoyl]amino]propanoic acid Traditional Name: 3-[4-(5-chloro-2-methoxy-phenyl)phenyl]-2-[[4-[4-(trifluoromethyl)phenyl]benzoyl]amino]propionic acid Formula: C30H23ClF3NO4 MolecularWeight: 553.95613

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C30H23ClF3NO4/c1-39-27-15-14-24(31)17-25(27)21-4-2-18(3-5-21)16-26(29(37)38)35-28(36)22-8-6-19(7-9-22)20-10-12-23(13-11-20)30(32,33)34/h2-15,17,26H,16H2,1H3,(H,35,36)(H,37,38)