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

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(2-nitrophenyl)-2-furamide Formula: C22H23N4O4+ MolecularWeight: 407.44242

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4/c1-24-12-14-25(15-13-24)19-9-5-3-7-17(19)23-22(27)21-11-10-20(30-21)16-6-2-4-8-18(16)26(28)29/h2-11H,12-15H2,1H3,(H,23,27)/p+1