6-bromanyl-3-nitro-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]quinoline

Systemtic Name: 6-bromanyl-3-nitro-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]quinoline Openeye Name: 6-bromo-3-nitro-4-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]quinoline CAS Name: 6-bromo-3-nitro-4-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]quinoline IUPAC Name: 6-bromo-3-nitro-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]quinoline Traditional Name: 6-bromo-3-nitro-4-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]quinoline Formula: C19H15BrF3N5O2 MolecularWeight: 482.25391

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C3=C4C=C(C=CC4=NC=C3[N+](=O)[O-])Br

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C3=C4C=C(C=CC4=NC=C3[N+](=O)[O-])Br

InChI

InChI=1S/C19H15BrF3N5O2/c20-13-2-3-15-14(9-13)18(16(11-24-15)28(29)30)27-7-5-26(6-8-27)17-4-1-12(10-25-17)19(21,22)23/h1-4,9-11H,5-8H2