N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-ethyl-N-(2-methylallyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-ethyl-N-(2-methylprop-2-enyl)-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-ethyl-2-(4-mesitylsulfonylpiperazin-1-ium-1-yl)-N-(2-methylallyl)acetamide Formula: C21H34N3O3S+ MolecularWeight: 408.57796

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCN(CC(=C)C)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C21H33N3O3S/c1-7-23(14-16(2)3)20(25)15-22-8-10-24(11-9-22)28(26,27)21-18(5)12-17(4)13-19(21)6/h12-13H,2,7-11,14-15H2,1,3-6H3/p+1