N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-5-nitro-furan-2-carboxamide chloride

Systemtic Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-5-nitro-furan-2-carboxamide chloride Openeye Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-5-nitro-furan-2-carboxamide chloride CAS Name: N-[[4-(4-methyl-1-piperazin-4-iumyl)phenyl]methyl]-5-nitro-2-furancarboxamide chloride IUPAC Name: N-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]methyl]-5-nitrofuran-2-carboxamide chloride Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)benzyl]-5-nitro-2-furamide chloride Formula: C17H21ClN4O4 MolecularWeight: 380.82604

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=CC=C(O3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)CNC(=O)C3=CC=C(O3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C17H20N4O4.ClH/c1-19-8-10-20(11-9-19)14-4-2-13(3-5-14)12-18-17(22)15-6-7-16(25-15)21(23)24;/h2-7H,8-12H2,1H3,(H,18,22);1H