N-(5-bromanylpyridin-2-yl)-2-(1-methyl-5-nitro-piperazin-2-yl)benzamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-(1-methyl-5-nitro-piperazin-2-yl)benzamide Openeye Name: N-(5-bromo-2-pyridyl)-2-(1-methyl-5-nitro-piperazin-2-yl)benzamide CAS Name: N-(5-bromo-2-pyridinyl)-2-(1-methyl-5-nitro-2-piperazinyl)benzamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-(1-methyl-5-nitropiperazin-2-yl)benzamide Traditional Name: N-(5-bromo-2-pyridyl)-2-(1-methyl-5-nitro-piperazin-2-yl)benzamide Formula: C17H18BrN5O3 MolecularWeight: 420.26052

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(NCC1C2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

CN1CC(NCC1C2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H18BrN5O3/c1-22-10-16(23(25)26)20-9-14(22)12-4-2-3-5-13(12)17(24)21-15-7-6-11(18)8-19-15/h2-8,14,16,20H,9-10H2,1H3,(H,19,21,24)