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

Systemtic Name: [2-[[tert-butylcarbamoyl(2-methylpropyl)amino]methyl]-4-chloranyl-phenyl] methanesulfonate Openeye Name: [2-[[tert-butylcarbamoyl(isobutyl)amino]methyl]-4-chloro-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-[[[(tert-butylamino)-oxomethyl]-(2-methylpropyl)amino]methyl]-4-chlorophenyl] ester IUPAC Name: [2-[[tert-butylcarbamoyl(2-methylpropyl)amino]methyl]-4-chlorophenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[[tert-butylcarbamoyl(isobutyl)amino]methyl]-4-chloro-phenyl] ester Formula: C17H27ClN2O4S MolecularWeight: 390.92528

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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)NC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H27ClN2O4S/c1-12(2)10-20(16(21)19-17(3,4)5)11-13-9-14(18)7-8-15(13)24-25(6,22)23/h7-9,12H,10-11H2,1-6H3,(H,19,21)