methyl-[(2S)-2-oxidanyl-3-(2,4,6-trimethylphenyl)sulfonyl-propyl]azanium

Systemtic Name: methyl-[(2S)-2-oxidanyl-3-(2,4,6-trimethylphenyl)sulfonyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(2,4,6-trimethylphenyl)sulfonyl-propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(2,4,6-trimethylphenyl)sulfonylpropyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(2,4,6-trimethylphenyl)sulfonylpropyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-mesitylsulfonyl-propyl]-methyl-ammonium Formula: C13H22NO3S+ MolecularWeight: 272.38368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)CC(C[NH2+]C)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)C[C@H](C[NH2+]C)O)C

InChI

InChI=1S/C13H21NO3S/c1-9-5-10(2)13(11(3)6-9)18(16,17)8-12(15)7-14-4/h5-6,12,14-15H,7-8H2,1-4H3/p+1/t12-/m0/s1