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

Systemtic Name: [3-[[cyclopentylcarbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[cyclopentanecarbonyl(isobutyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[cyclopentyl(oxo)methyl]-(2-methylpropyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[cyclopentanecarbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[cyclopentanecarbonyl(isobutyl)amino]methyl]phenyl] ester Formula: C18H27NO4S MolecularWeight: 353.47628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2CCCC2

Isomeric SMILES

CC(C)CN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2CCCC2

InChI

InChI=1S/C18H27NO4S/c1-14(2)12-19(18(20)16-8-4-5-9-16)13-15-7-6-10-17(11-15)23-24(3,21)22/h6-7,10-11,14,16H,4-5,8-9,12-13H2,1-3H3