N-(2-bromanyl-5-nitro-phenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide

Systemtic Name: N-(2-bromanyl-5-nitro-phenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide Openeye Name: N-(2-bromo-5-nitro-phenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide CAS Name: N-(2-bromo-5-nitrophenyl)-4-(3-methyl-5-phenyl-1-pyrazolyl)benzamide IUPAC Name: N-(2-bromo-5-nitrophenyl)-4-(3-methyl-5-phenylpyrazol-1-yl)benzamide Traditional Name: N-(2-bromo-5-nitro-phenyl)-4-(3-methyl-5-phenyl-pyrazol-1-yl)benzamide Formula: C23H17BrN4O3 MolecularWeight: 477.31008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C23H17BrN4O3/c1-15-13-22(16-5-3-2-4-6-16)27(26-15)18-9-7-17(8-10-18)23(29)25-21-14-19(28(30)31)11-12-20(21)24/h2-14H,1H3,(H,25,29)