3-[[4-[3-(5-chloranyl-1H-indol-2-yl)-3-oxidanylidene-2-[[2-(trifluoromethyloxy)phenyl]methyl]propyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[3-(5-chloranyl-1H-indol-2-yl)-3-oxidanylidene-2-[[2-(trifluoromethyloxy)phenyl]methyl]propyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[3-(5-chloro-1H-indol-2-yl)-3-oxo-2-[[2-(trifluoromethoxy)phenyl]methyl]propyl]benzoyl]amino]propanoic acid CAS Name: 3-[[[4-[3-(5-chloro-1H-indol-2-yl)-3-oxo-2-[[2-(trifluoromethoxy)phenyl]methyl]propyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[3-(5-chloro-1H-indol-2-yl)-3-oxo-2-[[2-(trifluoromethoxy)phenyl]methyl]propyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[4-[3-(5-chloro-1H-indol-2-yl)-3-keto-2-[2-(trifluoromethoxy)benzyl]propyl]benzoyl]amino]propionic acid Formula: C29H24ClF3N2O5 MolecularWeight: 572.95947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(CC2=CC=C(C=C2)C(=O)NCCC(=O)O)C(=O)C3=CC4=C(N3)C=CC(=C4)Cl)OC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CC(CC2=CC=C(C=C2)C(=O)NCCC(=O)O)C(=O)C3=CC4=C(N3)C=CC(=C4)Cl)OC(F)(F)F

InChI

InChI=1S/C29H24ClF3N2O5/c30-22-9-10-23-20(15-22)16-24(35-23)27(38)21(14-19-3-1-2-4-25(19)40-29(31,32)33)13-17-5-7-18(8-6-17)28(39)34-12-11-26(36)37/h1-10,15-16,21,35H,11-14H2,(H,34,39)(H,36,37)