(3R)-1-(1,3-benzodioxol-5-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(1,3-benzodioxol-5-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3R)-1-(1,3-benzodioxol-5-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3R)-1-(1,3-benzodioxol-5-yl)-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3R)-1-(1,3-benzodioxol-5-yl)-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3R)-1-(1,3-benzodioxol-5-yl)-5-keto-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]pyrrolidine-3-carboxamide Formula: C23H27N4O6S+ MolecularWeight: 487.54868

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3CC(=O)N(C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N4O6S/c1-25-8-10-26(11-9-25)34(30,31)19-5-2-17(3-6-19)24-23(29)16-12-22(28)27(14-16)18-4-7-20-21(13-18)33-15-32-20/h2-7,13,16H,8-12,14-15H2,1H3,(H,24,29)/p+1/t16-/m1/s1