N-[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]-2-bromanyl-5-nitro-benzamide

Systemtic Name: N-[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]-2-bromanyl-5-nitro-benzamide Openeye Name: N-[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]-2-bromo-5-nitro-benzamide CAS Name: N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-2-bromo-5-nitrobenzamide IUPAC Name: N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-2-bromo-5-nitrobenzamide Traditional Name: N-[5-(1H-benzimidazol-2-yl)-2-methyl-phenyl]-2-bromo-5-nitro-benzamide Formula: C21H15BrN4O3 MolecularWeight: 451.2728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C21H15BrN4O3/c1-12-6-7-13(20-23-17-4-2-3-5-18(17)24-20)10-19(12)25-21(27)15-11-14(26(28)29)8-9-16(15)22/h2-11H,1H3,(H,23,24)(H,25,27)