6-nitro-1-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]indazole

Systemtic Name: 6-nitro-1-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]indazole Openeye Name: 6-nitro-1-[[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methyl]indazole CAS Name: 6-nitro-1-[[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methyl]indazole IUPAC Name: 6-nitro-1-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methyl]indazole Traditional Name: 6-nitro-1-[[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methyl]indazole Formula: C18H17F3N6O2 MolecularWeight: 406.36179

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C18H17F3N6O2/c19-18(20,21)14-2-4-17(22-11-14)25-7-5-24(6-8-25)12-26-16-9-15(27(28)29)3-1-13(16)10-23-26/h1-4,9-11H,5-8,12H2