[4-[[[(2S)-butan-2-yl]-(2-methoxyethanoyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[[(2S)-butan-2-yl]-(2-methoxyethanoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(2-methoxyacetyl)-[(1S)-1-methylpropyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[(2S)-butan-2-yl]-(2-methoxy-1-oxoethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[[(2S)-butan-2-yl]-(2-methoxyacetyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(2-methoxyacetyl)-[(1S)-1-methylpropyl]amino]methyl]phenyl] ester Formula: C15H23NO5S MolecularWeight: 329.41182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)COC

Isomeric SMILES

CC[C@H](C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)COC

InChI

InChI=1S/C15H23NO5S/c1-5-12(2)16(15(17)11-20-3)10-13-6-8-14(9-7-13)21-22(4,18)19/h6-9,12H,5,10-11H2,1-4H3/t12-/m0/s1