[2-methoxy-5-[[propan-2-yl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [2-methoxy-5-[[propan-2-yl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [5-[[isopropyl-(2,4,6-trimethylphenyl)sulfonyl-amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-methoxy-5-[[propan-2-yl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[propan-2-yl-(2,4,6-trimethylphenyl)sulfonylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[isopropyl(mesitylsulfonyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C21H29NO6S2 MolecularWeight: 455.58806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO6S2/c1-14(2)22(30(25,26)21-16(4)10-15(3)11-17(21)5)13-18-8-9-19(27-6)20(12-18)28-29(7,23)24/h8-12,14H,13H2,1-7H3