N-[(1-oxidanidylpyridin-1-ium-2-yl)-oxidanyl-methyl]-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(1-oxidanidylpyridin-1-ium-2-yl)-oxidanyl-methyl]-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-[hydroxy-(1-oxido-2-pyridin-1-iumyl)methyl]-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-[hydroxy-(1-oxidopyridin-1-ium-2-yl)methyl]-N-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C24H20F3N3O3 MolecularWeight: 455.42911

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=CC=CC=C2C=C1C(=O)N(C3=CC=CC(=C3)C(F)(F)F)C(C4=CC=CC=[N+]4[O-])O

Isomeric SMILES

C1CNC2=CC=CC=C2C=C1C(=O)N(C3=CC=CC(=C3)C(F)(F)F)C(C4=CC=CC=[N+]4[O-])O

InChI

InChI=1S/C24H20F3N3O3/c25-24(26,27)18-7-5-8-19(15-18)30(23(32)21-10-3-4-13-29(21)33)22(31)17-11-12-28-20-9-2-1-6-16(20)14-17/h1-10,13-15,23,28,32H,11-12H2