1-(furan-2-ylcarbonyl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(furan-2-ylcarbonyl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]piperidine-4-carboxamide Openeye Name: 1-(furan-2-carbonyl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]piperidine-4-carboxamide CAS Name: 1-[2-furanyl(oxo)methyl]-N-[2-methoxy-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(furan-2-carbonyl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]piperidine-4-carboxamide Traditional Name: 1-(2-furoyl)-N-[2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]isonipecotamide Formula: C23H31N4O6S+ MolecularWeight: 491.58044

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)C3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)NC(=O)C3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C23H30N4O6S/c1-25-11-13-27(14-12-25)34(30,31)18-5-6-20(32-2)19(16-18)24-22(28)17-7-9-26(10-8-17)23(29)21-4-3-15-33-21/h3-6,15-17H,7-14H2,1-2H3,(H,24,28)/p+1