[5-[[(3,4-dichlorophenyl)carbonyl-propan-2-yl-amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[(3,4-dichlorophenyl)carbonyl-propan-2-yl-amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[(3,4-dichlorobenzoyl)-isopropyl-amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[[(3,4-dichlorophenyl)-oxomethyl]-propan-2-ylamino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[(3,4-dichlorobenzoyl)-propan-2-ylamino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[(3,4-dichlorobenzoyl)-isopropyl-amino]methyl]-2-methoxy-phenyl] ester Formula: C19H21Cl2NO5S MolecularWeight: 446.34474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(=O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H21Cl2NO5S/c1-12(2)22(19(23)14-6-7-15(20)16(21)10-14)11-13-5-8-17(26-3)18(9-13)27-28(4,24)25/h5-10,12H,11H2,1-4H3