4-ethyl-4-methyl-1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]piperidine-2,6-dione

Systemtic Name: 4-ethyl-4-methyl-1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]piperidine-2,6-dione Openeye Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-4-ethyl-4-methyl-piperidine-2,6-dione CAS Name: 1-[[4-(benzenesulfonyl)-1-piperazin-1-iumyl]methyl]-4-ethyl-4-methylpiperidine-2,6-dione IUPAC Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-4-ethyl-4-methylpiperidine-2,6-dione Traditional Name: 1-[(4-besylpiperazin-1-ium-1-yl)methyl]-4-ethyl-4-methyl-piperidine-2,6-quinone Formula: C19H28N3O4S+ MolecularWeight: 394.50832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=O)N(C(=O)C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCC1(CC(=O)N(C(=O)C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C19H27N3O4S/c1-3-19(2)13-17(23)22(18(24)14-19)15-20-9-11-21(12-10-20)27(25,26)16-7-5-4-6-8-16/h4-8H,3,9-15H2,1-2H3/p+1