[(2R)-1-[methyl-(phenylmethyl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2R)-1-[methyl-(phenylmethyl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1R)-1-[benzyl(methyl)carbamoyl]-3-methylsulfonyl-propyl]ammonium CAS Name: [(2R)-1-[methyl-(phenylmethyl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2R)-1-[benzyl(methyl)amino]-4-methylsulfonyl-1-oxobutan-2-yl]azanium Traditional Name: [(1R)-1-[benzyl(methyl)carbamoyl]-3-mesyl-propyl]ammonium Formula: C13H21N2O3S+ MolecularWeight: 285.38244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C(CCS(=O)(=O)C)[NH3+]

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)[C@@H](CCS(=O)(=O)C)[NH3+]

InChI

InChI=1S/C13H20N2O3S/c1-15(10-11-6-4-3-5-7-11)13(16)12(14)8-9-19(2,17)18/h3-7,12H,8-10,14H2,1-2H3/p+1/t12-/m1/s1