N-[2-oxidanyl-6-(pyrrolidin-1-ylmethylideneamino)-2,3-dihydro-1H-inden-1-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-oxidanyl-6-(pyrrolidin-1-ylmethylideneamino)-2,3-dihydro-1H-inden-1-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-hydroxy-6-(pyrrolidin-1-ylmethyleneamino)indan-1-yl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-hydroxy-6-(1-pyrrolidinylmethylideneamino)-2,3-dihydro-1H-inden-1-yl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-hydroxy-6-(pyrrolidin-1-ylmethylideneamino)-2,3-dihydro-1H-inden-1-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-hydroxy-6-(pyrrolidinomethyleneamino)indan-1-yl]-3-(trifluoromethyl)benzamide Formula: C22H22F3N3O2 MolecularWeight: 417.42419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C=NC2=CC3=C(CC(C3NC(=O)C4=CC(=CC=C4)C(F)(F)F)O)C=C2

Isomeric SMILES

C1CCN(C1)C=NC2=CC3=C(CC(C3NC(=O)C4=CC(=CC=C4)C(F)(F)F)O)C=C2

InChI

InChI=1S/C22H22F3N3O2/c23-22(24,25)16-5-3-4-15(10-16)21(30)27-20-18-12-17(7-6-14(18)11-19(20)29)26-13-28-8-1-2-9-28/h3-7,10,12-13,19-20,29H,1-2,8-9,11H2,(H,27,30)