[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-[2-nitro-4-(trifluoromethyl)phenyl]azanium

Systemtic Name: [2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-[2-nitro-4-(trifluoromethyl)phenyl]azanium Openeye Name: [2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-[2-nitro-4-(trifluoromethyl)phenyl]ammonium CAS Name: [2-(4-methyl-1-piperazinyl)-2-oxoethyl]-[2-nitro-4-(trifluoromethyl)phenyl]ammonium IUPAC Name: [2-(4-methylpiperazin-1-yl)-2-oxoethyl]-[2-nitro-4-(trifluoromethyl)phenyl]azanium Traditional Name: [2-keto-2-(4-methylpiperazino)ethyl]-[2-nitro-4-(trifluoromethyl)phenyl]ammonium Formula: C14H18F3N4O3+ MolecularWeight: 347.31293

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C[NH2+]C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C[NH2+]C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H17F3N4O3/c1-19-4-6-20(7-5-19)13(22)9-18-11-3-2-10(14(15,16)17)8-12(11)21(23)24/h2-3,8,18H,4-7,9H2,1H3/p+1