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

Systemtic Name: [4-[[[(2S)-butan-2-yl]-ethanoyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[acetyl-[(1S)-1-methylpropyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[acetyl-[(2S)-butan-2-yl]amino]methyl]phenyl] ester IUPAC Name: [4-[[acetyl-[(2S)-butan-2-yl]amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[acetyl-[(1S)-1-methylpropyl]amino]methyl]phenyl] ester Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO4S/c1-5-11(2)15(12(3)16)10-13-6-8-14(9-7-13)19-20(4,17)18/h6-9,11H,5,10H2,1-4H3/t11-/m0/s1