N-(1-azanylcyclopentyl)-1-methyl-2-oxidanylidene-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-1-ium-1-carboxamide

Systemtic Name: N-(1-azanylcyclopentyl)-1-methyl-2-oxidanylidene-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-1-ium-1-carboxamide Openeye Name: N-(1-aminocyclopentyl)-1-methyl-2-oxo-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-1-ium-1-carboxamide CAS Name: N-(1-aminocyclopentyl)-1-methyl-2-oxo-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-1-ium-1-carboxamide IUPAC Name: N-(1-aminocyclopentyl)-1-methyl-2-oxo-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-1-ium-1-carboxamide Traditional Name: N-(1-aminocyclopentyl)-2-keto-1-methyl-5-[4-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-1-ium-1-carboxamide Formula: C23H24F3N4O2+ MolecularWeight: 445.45747

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(=O)CN=C(C2=CC=CC=C21)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC4(CCCC4)N

Isomeric SMILES

C[N+]1(C(=O)CN=C(C2=CC=CC=C21)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC4(CCCC4)N

InChI

InChI=1S/C23H23F3N4O2/c1-30(21(32)29-22(27)12-4-5-13-22)18-7-3-2-6-17(18)20(28-14-19(30)31)15-8-10-16(11-9-15)23(24,25)26/h2-3,6-11H,4-5,12-14,27H2,1H3/p+1