N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-(3-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/c1-24-11-13-25(14-12-24)19-8-3-2-7-18(19)23-22(27)21-10-9-20(30-21)16-5-4-6-17(15-16)26(28)29/h2-10,15H,11-14H2,1H3,(H,23,27)/p+1