N-(2-methyl-1-phenyl-benzimidazol-5-yl)-2,4-dinitro-benzamide

Systemtic Name: N-(2-methyl-1-phenyl-benzimidazol-5-yl)-2,4-dinitro-benzamide Openeye Name: N-(2-methyl-1-phenyl-benzimidazol-5-yl)-2,4-dinitro-benzamide CAS Name: N-(2-methyl-1-phenyl-5-benzimidazolyl)-2,4-dinitrobenzamide IUPAC Name: N-(2-methyl-1-phenylbenzimidazol-5-yl)-2,4-dinitrobenzamide Traditional Name: N-(2-methyl-1-phenyl-benzimidazol-5-yl)-2,4-dinitro-benzamide Formula: C21H15N5O5 MolecularWeight: 417.3743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O5/c1-13-22-18-11-14(7-10-19(18)24(13)15-5-3-2-4-6-15)23-21(27)17-9-8-16(25(28)29)12-20(17)26(30)31/h2-12H,1H3,(H,23,27)