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

Systemtic Name: [3-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate Openeye Name: [3-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [3-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [3-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C20H26N2O6S MolecularWeight: 422.49524

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CCOC)CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCNC(=O)N(CCOC)CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H26N2O6S/c1-4-21-20(23)22(12-13-26-2)15-16-6-5-7-18(14-16)28-29(24,25)19-10-8-17(27-3)9-11-19/h5-11,14H,4,12-13,15H2,1-3H3,(H,21,23)