(3S)-6-chloranyl-3-piperazine-1,4-diium-1-yl-3-(trifluoromethyl)-1H-indol-2-one

Systemtic Name: (3S)-6-chloranyl-3-piperazine-1,4-diium-1-yl-3-(trifluoromethyl)-1H-indol-2-one Openeye Name: (3S)-6-chloro-3-piperazine-1,4-diium-1-yl-3-(trifluoromethyl)indolin-2-one CAS Name: (3S)-6-chloro-3-(1-piperazine-1,4-diiumyl)-3-(trifluoromethyl)-1H-indol-2-one IUPAC Name: (3S)-6-chloro-3-piperazine-1,4-diium-1-yl-3-(trifluoromethyl)-1H-indol-2-one Traditional Name: (3S)-6-chloro-3-piperazine-1,4-diium-1-yl-3-(trifluoromethyl)oxindole Formula: C13H15ClF3N3O+2 MolecularWeight: 321.72591

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)C2(C3=C(C=C(C=C3)Cl)NC2=O)C(F)(F)F

Isomeric SMILES

C1C[NH+](CC[NH2+]1)[C@]2(C3=C(C=C(C=C3)Cl)NC2=O)C(F)(F)F

InChI

InChI=1S/C13H13ClF3N3O/c14-8-1-2-9-10(7-8)19-11(21)12(9,13(15,16)17)20-5-3-18-4-6-20/h1-2,7,18H,3-6H2,(H,19,21)/p+2/t12-/m0/s1