5-nitro-N-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonylphenyl]furan-2-carboxamide

Systemtic Name: 5-nitro-N-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonylphenyl]furan-2-carboxamide Openeye Name: 5-nitro-N-[2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carbonyl]phenyl]furan-2-carboxamide CAS Name: 5-nitro-N-[2-[oxo-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]methyl]phenyl]-2-furancarboxamide IUPAC Name: 5-nitro-N-[2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-carbonyl]phenyl]furan-2-carboxamide Traditional Name: N-[2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-carbonyl]phenyl]-5-nitro-2-furamide Formula: C22H26N5O6+ MolecularWeight: 456.47174

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O6/c28-19(25-9-3-4-10-25)15-24-11-13-26(14-12-24)22(30)16-5-1-2-6-17(16)23-21(29)18-7-8-20(33-18)27(31)32/h1-2,5-8H,3-4,9-15H2,(H,23,29)/p+1