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

Systemtic Name: [4-chloranyl-2-[[2-methylpropanoyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-chloro-2-[[isobutyl(2-methylpropanoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-chloro-2-[[(2-methyl-1-oxopropyl)-(2-methylpropyl)amino]methyl]phenyl] ester IUPAC Name: [4-chloro-2-[[2-methylpropanoyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-chloro-2-[[isobutyl(isobutyryl)amino]methyl]phenyl] ester Formula: C16H24ClNO4S MolecularWeight: 361.88406

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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)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H24ClNO4S/c1-11(2)9-18(16(19)12(3)4)10-13-8-14(17)6-7-15(13)22-23(5,20)21/h6-8,11-12H,9-10H2,1-5H3