phenyl 2-[(4-methoxyphenyl)methyl-methyl-amino]ethanesulfonate

Systemtic Name: phenyl 2-[(4-methoxyphenyl)methyl-methyl-amino]ethanesulfonate Openeye Name: phenyl 2-[(4-methoxyphenyl)methyl-methyl-amino]ethanesulfonate CAS Name: 2-[(4-methoxyphenyl)methyl-methylamino]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[(4-methoxyphenyl)methyl-methylamino]ethanesulfonate Traditional Name: 2-[methyl(p-anisyl)amino]ethanesulfonic acid phenyl ester Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCS(=O)(=O)OC1=CC=CC=C1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CN(CCS(=O)(=O)OC1=CC=CC=C1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H21NO4S/c1-18(14-15-8-10-16(21-2)11-9-15)12-13-23(19,20)22-17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3