phenyl 2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanesulfonate

Systemtic Name: phenyl 2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanesulfonate Openeye Name: phenyl 2-[(3,4-dimethoxyphenyl)methyl-methyl-amino]ethanesulfonate CAS Name: 2-[(3,4-dimethoxyphenyl)methyl-methylamino]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[(3,4-dimethoxyphenyl)methyl-methylamino]ethanesulfonate Traditional Name: 2-[methyl(veratryl)amino]ethanesulfonic acid phenyl ester Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO5S/c1-19(14-15-9-10-17(22-2)18(13-15)23-3)11-12-25(20,21)24-16-7-5-4-6-8-16/h4-10,13H,11-12,14H2,1-3H3