N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-methyl-3,5-dinitro-benzamide

Systemtic Name: N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-methyl-3,5-dinitro-benzamide Openeye Name: N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-methyl-3,5-dinitro-benzamide CAS Name: N-(3-cyano-2-pyrimido[1,2-a]benzimidazolyl)-2-methyl-3,5-dinitrobenzamide IUPAC Name: N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-methyl-3,5-dinitrobenzamide Traditional Name: N-(3-cyanopyrimido[1,2-a]benzimidazol-2-yl)-2-methyl-3,5-dinitro-benzamide Formula: C19H11N7O5 MolecularWeight: 417.33454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)NC2=NC3=NC4=CC=CC=C4N3C=C2C#N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)NC2=NC3=NC4=CC=CC=C4N3C=C2C#N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H11N7O5/c1-10-13(6-12(25(28)29)7-16(10)26(30)31)18(27)22-17-11(8-20)9-24-15-5-3-2-4-14(15)21-19(24)23-17/h2-7,9H,1H3,(H,21,22,23,27)