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

Systemtic Name: [3-[[(2,4-dichlorophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[(2,4-dichlorophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[(2,4-dichloroanilino)-oxomethyl]-(2-methoxyethyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[(2,4-dichlorophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[(2,4-dichlorophenyl)carbamoyl-(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C18H20Cl2N2O5S MolecularWeight: 447.3328

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H20Cl2N2O5S/c1-26-9-8-22(18(23)21-17-7-6-14(19)11-16(17)20)12-13-4-3-5-15(10-13)27-28(2,24)25/h3-7,10-11H,8-9,12H2,1-2H3,(H,21,23)