1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]pyrrolidine-2,5-dione Openeye Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]pyrrolidine-2,5-dione CAS Name: 1-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]pyrrolidine-2,5-dione IUPAC Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]pyrrolidine-2,5-dione Traditional Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]pyrrolidine-2,5-quinone Formula: C15H20N3O4S+ MolecularWeight: 338.402

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)CCC3=O

InChI

InChI=1S/C15H19N3O4S/c1-16-8-10-17(11-9-16)23(21,22)13-4-2-12(3-5-13)18-14(19)6-7-15(18)20/h2-5H,6-11H2,1H3/p+1