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

Systemtic Name: [2-[[tert-butylcarbamoyl(2-methoxyethyl)amino]methyl]-4-chloranyl-phenyl] ethanesulfonate Openeye Name: [2-[[tert-butylcarbamoyl(2-methoxyethyl)amino]methyl]-4-chloro-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-[[[(tert-butylamino)-oxomethyl]-(2-methoxyethyl)amino]methyl]-4-chlorophenyl] ester IUPAC Name: [2-[[tert-butylcarbamoyl(2-methoxyethyl)amino]methyl]-4-chlorophenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [2-[[tert-butylcarbamoyl(2-methoxyethyl)amino]methyl]-4-chloro-phenyl] ester Formula: C17H27ClN2O5S MolecularWeight: 406.92468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27ClN2O5S/c1-6-26(22,23)25-15-8-7-14(18)11-13(15)12-20(9-10-24-5)16(21)19-17(2,3)4/h7-8,11H,6,9-10,12H2,1-5H3,(H,19,21)