3-[2-phenyl-5-(trifluoromethyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid

Systemtic Name: 3-[2-phenyl-5-(trifluoromethyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid Openeye Name: 3-[2-phenyl-5-(trifluoromethyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid CAS Name: 3-[2-phenyl-5-(trifluoromethyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid IUPAC Name: 3-[2-phenyl-5-(trifluoromethyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid Traditional Name: 3-[2-phenyl-5-(trifluoromethyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid Formula: C22H18F3NO2 MolecularWeight: 385.37903

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C(F)(F)F)C=C(N2C3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(CC1C(F)(F)F)C=C(N2C3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H18F3NO2/c23-22(24,25)17-9-10-19-16(11-17)13-20(14-5-2-1-3-6-14)26(19)18-8-4-7-15(12-18)21(27)28/h1-8,12-13,17H,9-11H2,(H,27,28)