N-[3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide

Systemtic Name: N-[3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-[3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-[3-[2-(4-morpholin-4-iumyl)ethyl]-1H-benzimidazol-3-ium-2-yl]-5-[(4-nitro-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-[3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: N-[3-(2-morpholin-4-ium-4-ylethyl)-1H-benzimidazol-3-ium-2-yl]-5-[(4-nitropyrazol-1-yl)methyl]-2-furamide Formula: C22H25N7O5+2 MolecularWeight: 467.4778

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC[N+]2=C(NC3=CC=CC=C32)NC(=O)C4=CC=C(O4)CN5C=C(C=N5)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC[N+]2=C(NC3=CC=CC=C32)NC(=O)C4=CC=C(O4)CN5C=C(C=N5)[N+](=O)[O-]

InChI

InChI=1S/C22H23N7O5/c30-21(20-6-5-17(34-20)15-27-14-16(13-23-27)29(31)32)25-22-24-18-3-1-2-4-19(18)28(22)8-7-26-9-11-33-12-10-26/h1-6,13-14H,7-12,15H2,(H,24,25,30)/p+2