N-(5-bromanylpyridin-2-yl)-1-[(5-nitroindazol-1-yl)methyl]piperidine-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-[(5-nitroindazol-1-yl)methyl]piperidine-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-1-[(5-nitroindazol-1-yl)methyl]piperidine-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-1-[(5-nitro-1-indazolyl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-1-[(5-nitroindazol-1-yl)methyl]piperidine-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-1-[(5-nitroindazol-1-yl)methyl]nipecotamide Formula: C19H19BrN6O3 MolecularWeight: 459.29656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)C(=O)NC4=NC=C(C=C4)Br

Isomeric SMILES

C1CC(CN(C1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)C(=O)NC4=NC=C(C=C4)Br

InChI

InChI=1S/C19H19BrN6O3/c20-15-3-6-18(21-10-15)23-19(27)13-2-1-7-24(11-13)12-25-17-5-4-16(26(28)29)8-14(17)9-22-25/h3-6,8-10,13H,1-2,7,11-12H2,(H,21,23,27)