2-[[(2R)-2-azaniumyl-4-methylsulfonyl-butanoyl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[(2R)-2-azaniumyl-4-methylsulfonyl-butanoyl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[(2R)-2-azaniumyl-4-methylsulfonyl-butanoyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(2R)-2-ammonio-4-methylsulfonyl-1-oxobutyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[(2R)-2-azaniumyl-4-methylsulfonylbutanoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[(2R)-2-ammonio-4-mesyl-butanoyl]amino]ethyl-diisopropyl-ammonium Formula: C13H31N3O3S+2 MolecularWeight: 309.46854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H29N3O3S/c1-10(2)16(11(3)4)8-7-15-13(17)12(14)6-9-20(5,18)19/h10-12H,6-9,14H2,1-5H3,(H,15,17)/p+2/t12-/m1/s1