[3-[[(2R)-2-azaniumyl-4-methylsulfonyl-butanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[(2R)-2-azaniumyl-4-methylsulfonyl-butanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[(2R)-2-azaniumyl-4-methylsulfonyl-butanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[(2R)-2-ammonio-4-methylsulfonyl-1-oxobutyl]amino]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[(2R)-2-azaniumyl-4-methylsulfonylbutanoyl]amino]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[(2R)-2-ammonio-4-mesyl-butanoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C12H29N3O3S+2 MolecularWeight: 295.44196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C(CCS(=O)(=O)C)[NH3+])C[NH+](C)C

Isomeric SMILES

CC(C)(CNC(=O)[C@@H](CCS(=O)(=O)C)[NH3+])C[NH+](C)C

InChI

InChI=1S/C12H27N3O3S/c1-12(2,9-15(3)4)8-14-11(16)10(13)6-7-19(5,17)18/h10H,6-9,13H2,1-5H3,(H,14,16)/p+2/t10-/m1/s1