3,5-dimethyl-4-[4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]sulfonyl-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]sulfonyl-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[4-(2-methylallyl)piperazin-4-ium-1-yl]sulfonyl-isoxazole CAS Name: 3,5-dimethyl-4-[[4-(2-methylprop-2-enyl)-1-piperazin-4-iumyl]sulfonyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]sulfonyl-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[4-(2-methylallyl)piperazin-4-ium-1-yl]sulfonyl-isoxazole Formula: C13H22N3O3S+ MolecularWeight: 300.39708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=C)C

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CC[NH+](CC2)CC(=C)C

InChI

InChI=1S/C13H21N3O3S/c1-10(2)9-15-5-7-16(8-6-15)20(17,18)13-11(3)14-19-12(13)4/h1,5-9H2,2-4H3/p+1