[(2S)-butan-2-yl]-[(4-methoxy-3-methylsulfonyloxy-phenyl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(4-methoxy-3-methylsulfonyloxy-phenyl)methyl]azanium Openeye Name: (4-methoxy-3-methylsulfonyloxy-phenyl)methyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(4-methoxy-3-methylsulfonyloxyphenyl)methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(4-methoxy-3-methylsulfonyloxyphenyl)methyl]azanium Traditional Name: (4-methoxy-3-methylsulfonyloxy-benzyl)-[(1S)-1-methylpropyl]ammonium Formula: C13H22NO4S+ MolecularWeight: 288.38308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=CC(=C(C=C1)OC)OS(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO4S/c1-5-10(2)14-9-11-6-7-12(17-3)13(8-11)18-19(4,15)16/h6-8,10,14H,5,9H2,1-4H3/p+1/t10-/m0/s1