2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-ynyl-ethanamide Openeye Name: 2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-ynyl-acetamide CAS Name: 2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-prop-2-ynylacetamide IUPAC Name: 2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-prop-2-ynylacetamide Traditional Name: 2-(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)-N-propargyl-acetamide Formula: C18H26N3O3S+ MolecularWeight: 364.48234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC#C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NCC#C

InChI

InChI=1S/C18H25N3O3S/c1-4-9-19-18(22)14-20-10-12-21(13-11-20)25(23,24)17-7-5-16(6-8-17)15(2)3/h1,5-8,15H,9-14H2,2-3H3,(H,19,22)/p+1