3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(4-methoxy-2-methyl-phenyl)benzamide

Systemtic Name: 3-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-(4-methoxy-2-methyl-phenyl)benzamide Openeye Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(4-methoxy-2-methyl-phenyl)benzamide CAS Name: 3-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-(4-methoxy-2-methylphenyl)benzamide IUPAC Name: 3-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-(4-methoxy-2-methylphenyl)benzamide Traditional Name: 3-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-(4-methoxy-2-methyl-phenyl)benzamide Formula: C19H17BrN4O4 MolecularWeight: 445.26668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=O)C2=CC(=CC=C2)CN3C=C(C(=N3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H17BrN4O4/c1-12-8-15(28-2)6-7-17(12)21-19(25)14-5-3-4-13(9-14)10-23-11-16(20)18(22-23)24(26)27/h3-9,11H,10H2,1-2H3,(H,21,25)