[3-[[2-methoxyethanoyl(2-methoxyethyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [3-[[2-methoxyethanoyl(2-methoxyethyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate Openeye Name: [3-[[(2-methoxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [3-[[2-methoxyethyl-(2-methoxy-1-oxoethyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[(2-methoxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [3-[[(2-methoxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C20H25NO7S MolecularWeight: 423.48

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)COC

Isomeric SMILES

COCCN(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)COC

InChI

InChI=1S/C20H25NO7S/c1-25-12-11-21(20(22)15-26-2)14-16-5-4-6-18(13-16)28-29(23,24)19-9-7-17(27-3)8-10-19/h4-10,13H,11-12,14-15H2,1-3H3