(3S)-3-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]piperazin-4-ium

Systemtic Name: (3S)-3-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]piperazin-4-ium Openeye Name: (3S)-3-methyl-1-[5-(trifluoromethyl)-2-pyridyl]piperazin-4-ium CAS Name: (3S)-3-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]piperazin-4-ium IUPAC Name: (3S)-3-methyl-1-[5-(trifluoromethyl)pyridin-2-yl]piperazin-4-ium Traditional Name: (3S)-3-methyl-1-[5-(trifluoromethyl)-2-pyridyl]piperazin-4-ium Formula: C11H15F3N3+ MolecularWeight: 246.25211

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH2+]1)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

C[C@H]1CN(CC[NH2+]1)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C11H14F3N3/c1-8-7-17(5-4-15-8)10-3-2-9(6-16-10)11(12,13)14/h2-3,6,8,15H,4-5,7H2,1H3/p+1/t8-/m0/s1