4-methyl-N-(4-methylphenyl)sulfonyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-methyl-N-(4-methylphenyl)sulfonyl-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-methyl-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)-N-(p-tolylsulfonyl)piperazin-4-ium-1-carboxamide CAS Name: 4-methyl-N-(4-methylphenyl)sulfonyl-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-methyl-N-(4-methylphenyl)sulfonyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(2-keto-2-pyrrolidino-ethyl)-4-methyl-N-tosyl-piperazin-4-ium-1-carboxamide Formula: C19H29N4O4S+ MolecularWeight: 409.52296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCCC2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCCC2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H28N4O4S/c1-16-5-7-17(8-6-16)28(26,27)23(15-18(24)21-9-3-4-10-21)19(25)22-13-11-20(2)12-14-22/h5-8H,3-4,9-15H2,1-2H3/p+1