1-[2-(4-phenethylpiperazin-4-ium-1-yl)sulfonylethyl]piperidine-2,6-dione

Systemtic Name: 1-[2-(4-phenethylpiperazin-4-ium-1-yl)sulfonylethyl]piperidine-2,6-dione Openeye Name: 1-[2-(4-phenethylpiperazin-4-ium-1-yl)sulfonylethyl]piperidine-2,6-dione CAS Name: 1-[2-[(4-phenethyl-1-piperazin-4-iumyl)sulfonyl]ethyl]piperidine-2,6-dione IUPAC Name: 1-[2-(4-phenethylpiperazin-4-ium-1-yl)sulfonylethyl]piperidine-2,6-dione Traditional Name: 1-[2-(4-phenethylpiperazin-4-ium-1-yl)sulfonylethyl]piperidine-2,6-quinone Formula: C19H28N3O4S+ MolecularWeight: 394.50832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C(=O)C1)CCS(=O)(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

C1CC(=O)N(C(=O)C1)CCS(=O)(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H27N3O4S/c23-18-7-4-8-19(24)22(18)15-16-27(25,26)21-13-11-20(12-14-21)10-9-17-5-2-1-3-6-17/h1-3,5-6H,4,7-16H2/p+1