[3-[[(2,4-dichlorophenyl)carbonyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[(2,4-dichlorophenyl)carbonyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[(2,4-dichlorobenzoyl)-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[(2,4-dichlorophenyl)-oxomethyl]-(2-methoxyethyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[(2,4-dichlorobenzoyl)-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[(2,4-dichlorobenzoyl)-(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C18H19Cl2NO5S MolecularWeight: 432.31816

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H19Cl2NO5S/c1-25-9-8-21(18(22)16-7-6-14(19)11-17(16)20)12-13-4-3-5-15(10-13)26-27(2,23)24/h3-7,10-11H,8-9,12H2,1-2H3