[4-[[butan-2-yl-(2,4-dichlorophenyl)carbonyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[butan-2-yl-(2,4-dichlorophenyl)carbonyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(2,4-dichlorobenzoyl)-sec-butyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[butan-2-yl-[(2,4-dichlorophenyl)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[butan-2-yl-(2,4-dichlorobenzoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(2,4-dichlorobenzoyl)-sec-butyl-amino]methyl]phenyl] ester Formula: C19H21Cl2NO4S MolecularWeight: 430.34534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21Cl2NO4S/c1-4-13(2)22(19(23)17-10-7-15(20)11-18(17)21)12-14-5-8-16(9-6-14)26-27(3,24)25/h5-11,13H,4,12H2,1-3H3