1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]piperidine-2,6-dione

Systemtic Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]piperidine-2,6-dione Openeye Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]piperidine-2,6-dione CAS Name: 1-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]piperidine-2,6-dione IUPAC Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]piperidine-2,6-dione Traditional Name: 1-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]piperidine-2,6-quinone Formula: C16H22N3O4S+ MolecularWeight: 352.42858

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)CCCC3=O

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)CCCC3=O

InChI

InChI=1S/C16H21N3O4S/c1-17-9-11-18(12-10-17)24(22,23)14-7-5-13(6-8-14)19-15(20)3-2-4-16(19)21/h5-8H,2-4,9-12H2,1H3/p+1