(2R)-N-tert-butyl-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-tert-butyl-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-tert-butyl-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-tert-butyl-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-tert-butyl-2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-tert-butyl-2-(4-mesitylsulfonylpiperazin-1-ium-1-yl)propionamide Formula: C20H34N3O3S+ MolecularWeight: 396.56726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CC[NH+](CC2)[C@H](C)C(=O)NC(C)(C)C)C

InChI

InChI=1S/C20H33N3O3S/c1-14-12-15(2)18(16(3)13-14)27(25,26)23-10-8-22(9-11-23)17(4)19(24)21-20(5,6)7/h12-13,17H,8-11H2,1-7H3,(H,21,24)/p+1/t17-/m1/s1