[4-[methylsulfonyl-[(4-phenylmethoxyphenyl)methyl]amino]phenyl] methanesulfonate

Systemtic Name: [4-[methylsulfonyl-[(4-phenylmethoxyphenyl)methyl]amino]phenyl] methanesulfonate Openeye Name: [4-[(4-benzyloxyphenyl)methyl-methylsulfonyl-amino]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[methylsulfonyl-[(4-phenylmethoxyphenyl)methyl]amino]phenyl] ester IUPAC Name: [4-[methylsulfonyl-[(4-phenylmethoxyphenyl)methyl]amino]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(4-benzoxybenzyl)-mesyl-amino]phenyl] ester Formula: C22H23NO6S2 MolecularWeight: 461.55112

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C3=CC=C(C=C3)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C3=CC=C(C=C3)OS(=O)(=O)C

InChI

InChI=1S/C22H23NO6S2/c1-30(24,25)23(20-10-14-22(15-11-20)29-31(2,26)27)16-18-8-12-21(13-9-18)28-17-19-6-4-3-5-7-19/h3-15H,16-17H2,1-2H3