[4-[[3-methoxypropyl-(4-methylphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[3-methoxypropyl-(4-methylphenyl)sulfonyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[3-methoxypropyl(p-tolylsulfonyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[3-methoxypropyl-(4-methylphenyl)sulfonylamino]methyl]phenyl] ester IUPAC Name: [4-[[3-methoxypropyl-(4-methylphenyl)sulfonylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[3-methoxypropyl(tosyl)amino]methyl]phenyl] ester Formula: C19H25NO6S2 MolecularWeight: 427.5349

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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