[(2R)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2R)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1R)-1-(4-methyl-1,4-diazepan-4-ium-1-carbonyl)-3-methylsulfonyl-propyl]ammonium CAS Name: [(2R)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-4-methylsulfonyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2R)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-4-methylsulfonyl-1-oxobutan-2-yl]azanium Traditional Name: [(1R)-3-mesyl-1-(4-methyl-1,4-diazepan-4-ium-1-carbonyl)propyl]ammonium Formula: C11H25N3O3S+2 MolecularWeight: 279.3995

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C(CCS(=O)(=O)C)[NH3+]

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)[C@@H](CCS(=O)(=O)C)[NH3+]

InChI

InChI=1S/C11H23N3O3S/c1-13-5-3-6-14(8-7-13)11(15)10(12)4-9-18(2,16)17/h10H,3-9,12H2,1-2H3/p+2/t10-/m1/s1