[3-[[2-methylpropyl(methylsulfonyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[2-methylpropyl(methylsulfonyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[isobutyl(methylsulfonyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[2-methylpropyl(methylsulfonyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[2-methylpropyl(methylsulfonyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[isobutyl(mesyl)amino]methyl]phenyl] ester Formula: C13H21NO5S2 MolecularWeight: 335.43954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC(=CC=C1)OS(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CC(C)CN(CC1=CC(=CC=C1)OS(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C13H21NO5S2/c1-11(2)9-14(20(3,15)16)10-12-6-5-7-13(8-12)19-21(4,17)18/h5-8,11H,9-10H2,1-4H3