3-[[4-[[4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-phenyl]methoxy]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[[4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-phenyl]methoxy]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[[4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-phenyl]methoxy]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[[4-[3,5-bis(trifluoromethyl)phenyl]-2-methylphenyl]methoxy]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[[4-[3,5-bis(trifluoromethyl)phenyl]-2-methylphenyl]methoxy]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[4-[3,5-bis(trifluoromethyl)phenyl]-2-methyl-benzyl]oxybenzoyl]amino]propionic acid Formula: C26H21F6NO4 MolecularWeight: 525.439659

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)COC3=CC=C(C=C3)C(=O)NCCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)COC3=CC=C(C=C3)C(=O)NCCC(=O)O

InChI

InChI=1S/C26H21F6NO4/c1-15-10-17(19-11-20(25(27,28)29)13-21(12-19)26(30,31)32)2-3-18(15)14-37-22-6-4-16(5-7-22)24(36)33-9-8-23(34)35/h2-7,10-13H,8-9,14H2,1H3,(H,33,36)(H,34,35)