3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(2,5-dimethoxyphenyl)benzamide

Systemtic Name: 3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(2,5-dimethoxyphenyl)benzamide Openeye Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(2,5-dimethoxyphenyl)benzamide CAS Name: 3-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(2,5-dimethoxyphenyl)benzamide IUPAC Name: 3-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(2,5-dimethoxyphenyl)benzamide Traditional Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(2,5-dimethoxyphenyl)benzamide Formula: C19H17BrN4O5 MolecularWeight: 461.26608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H17BrN4O5/c1-28-14-6-7-17(29-2)16(9-14)21-19(25)13-5-3-4-12(8-13)10-23-11-15(20)18(22-23)24(26)27/h3-9,11H,10H2,1-2H3,(H,21,25)