2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-N-propan-2-yl-ethanamide Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isopropyl-N-methyl-acetamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-methyl-N-propan-2-ylacetamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-N-propan-2-ylacetamide Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-isopropyl-N-methyl-acetamide Formula: C18H30N3O3S+ MolecularWeight: 368.5141

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N(C)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N(C)C(C)C)C

InChI

InChI=1S/C18H29N3O3S/c1-14(2)19(5)18(22)13-20-8-10-21(11-9-20)25(23,24)17-7-6-15(3)16(4)12-17/h6-7,12,14H,8-11,13H2,1-5H3/p+1