[4-[[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[isobutyl-(4-methoxyphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[isobutyl-(4-methoxyphenyl)sulfonyl-amino]methyl]phenyl] ester Formula: C19H25NO6S2 MolecularWeight: 427.5349

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO6S2/c1-15(2)13-20(28(23,24)19-11-9-17(25-3)10-12-19)14-16-5-7-18(8-6-16)26-27(4,21)22/h5-12,15H,13-14H2,1-4H3