N-(5-bromanylpyridin-2-yl)-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(5-bromo-2-pyridyl)-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(5-bromo-2-pyridinyl)-1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(5-bromopyridin-2-yl)-1-[(2-chloro-4-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(5-bromo-2-pyridyl)-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C16H11BrClN5O4 MolecularWeight: 452.64664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OCN2C=CC(=N2)C(=O)NC3=NC=C(C=C3)Br

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OCN2C=CC(=N2)C(=O)NC3=NC=C(C=C3)Br

InChI

InChI=1S/C16H11BrClN5O4/c17-10-1-4-15(19-8-10)20-16(24)13-5-6-22(21-13)9-27-14-3-2-11(23(25)26)7-12(14)18/h1-8H,9H2,(H,19,20,24)