N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-5-(4-ethanoylphenyl)-2-(trifluoromethyloxy)benzamide

Systemtic Name: N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-5-(4-ethanoylphenyl)-2-(trifluoromethyloxy)benzamide Openeye Name: 5-(4-acetylphenyl)-N-[1-(cyanomethyl)-2-(1H-indol-3-yl)ethyl]-2-(trifluoromethoxy)benzamide CAS Name: 5-(4-acetylphenyl)-N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-2-(trifluoromethoxy)benzamide IUPAC Name: 5-(4-acetylphenyl)-N-[1-cyano-3-(1H-indol-3-yl)propan-2-yl]-2-(trifluoromethoxy)benzamide Traditional Name: 5-(4-acetylphenyl)-N-[1-(cyanomethyl)-2-(1H-indol-3-yl)ethyl]-2-(trifluoromethoxy)benzamide Formula: C28H22F3N3O3 MolecularWeight: 505.48779

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(F)(F)F)C(=O)NC(CC#N)CC3=CNC4=CC=CC=C43

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C2=CC(=C(C=C2)OC(F)(F)F)C(=O)NC(CC#N)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C28H22F3N3O3/c1-17(35)18-6-8-19(9-7-18)20-10-11-26(37-28(29,30)31)24(15-20)27(36)34-22(12-13-32)14-21-16-33-25-5-3-2-4-23(21)25/h2-11,15-16,22,33H,12,14H2,1H3,(H,34,36)