N-[1-butyl-2-[(2-methylimidazol-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide

Systemtic Name: N-[1-butyl-2-[(2-methylimidazol-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide Openeye Name: N-[1-butyl-2-[(2-methylimidazol-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide CAS Name: N-[1-butyl-2-[(2-methyl-1-imidazolyl)methyl]-5-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[1-butyl-2-[(2-methylimidazol-1-yl)methyl]benzimidazol-5-yl]-3-nitrobenzamide Traditional Name: N-[1-butyl-2-[(2-methylimidazol-1-yl)methyl]benzimidazol-5-yl]-3-nitro-benzamide Formula: C23H24N6O3 MolecularWeight: 432.47506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=C1CN4C=CN=C4C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N=C1CN4C=CN=C4C

InChI

InChI=1S/C23H24N6O3/c1-3-4-11-28-21-9-8-18(25-23(30)17-6-5-7-19(13-17)29(31)32)14-20(21)26-22(28)15-27-12-10-24-16(27)2/h5-10,12-14H,3-4,11,15H2,1-2H3,(H,25,30)