N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitro-benzamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitro-benzamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitro-benzamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitrobenzamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-3,5-dinitro-benzamide Formula: C16H13N5O5 MolecularWeight: 355.30492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O5/c22-16(10-7-11(20(23)24)9-12(8-10)21(25)26)17-6-5-15-18-13-3-1-2-4-14(13)19-15/h1-4,7-9H,5-6H2,(H,17,22)(H,18,19)