[4-chloranyl-2-[[cyclobutylcarbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-chloranyl-2-[[cyclobutylcarbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-chloro-2-[[cyclobutanecarbonyl(isobutyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-chloro-2-[[[cyclobutyl(oxo)methyl]-(2-methylpropyl)amino]methyl]phenyl] ester IUPAC Name: [4-chloro-2-[[cyclobutanecarbonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-chloro-2-[[cyclobutanecarbonyl(isobutyl)amino]methyl]phenyl] ester Formula: C17H24ClNO4S MolecularWeight: 373.89476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=C(C=CC(=C1)Cl)OS(=O)(=O)C)C(=O)C2CCC2

Isomeric SMILES

CC(C)CN(CC1=C(C=CC(=C1)Cl)OS(=O)(=O)C)C(=O)C2CCC2

InChI

InChI=1S/C17H24ClNO4S/c1-12(2)10-19(17(20)13-5-4-6-13)11-14-9-15(18)7-8-16(14)23-24(3,21)22/h7-9,12-13H,4-6,10-11H2,1-3H3