[4-[[2-methoxyethyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[2-methoxyethyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[2-methoxyethyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[2-methoxyethyl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]phenyl] ester IUPAC Name: [4-[[2-methoxyethyl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[mesitylsulfonyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C20H27NO6S2 MolecularWeight: 441.56148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCOC)CC2=CC=C(C=C2)OS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(CCOC)CC2=CC=C(C=C2)OS(=O)(=O)C)C

InChI

InChI=1S/C20H27NO6S2/c1-15-12-16(2)20(17(3)13-15)29(24,25)21(10-11-26-4)14-18-6-8-19(9-7-18)27-28(5,22)23/h6-9,12-13H,10-11,14H2,1-5H3