[4-chloranyl-2-[[2-methoxyethyl(2-methylpropanoyl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [4-chloranyl-2-[[2-methoxyethyl(2-methylpropanoyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [4-chloro-2-[[2-methoxyethyl(2-methylpropanoyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-chloro-2-[[2-methoxyethyl-(2-methyl-1-oxopropyl)amino]methyl]phenyl] ester IUPAC Name: [4-chloro-2-[[2-methoxyethyl(2-methylpropanoyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-chloro-2-[[isobutyryl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C16H24ClNO5S MolecularWeight: 377.88346

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=C(C=C1)Cl)CN(CCOC)C(=O)C(C)C

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=C(C=C1)Cl)CN(CCOC)C(=O)C(C)C

InChI

InChI=1S/C16H24ClNO5S/c1-5-24(20,21)23-15-7-6-14(17)10-13(15)11-18(8-9-22-4)16(19)12(2)3/h6-7,10,12H,5,8-9,11H2,1-4H3