[5-[(2-dimethylaminoethylamino)methyl]-2-methoxy-phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [5-[(2-dimethylaminoethylamino)methyl]-2-methoxy-phenyl] 4-methoxybenzenesulfonate Openeye Name: [5-[(2-dimethylaminoethylamino)methyl]-2-methoxy-phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [5-[(2-dimethylaminoethylamino)methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[(2-dimethylaminoethylamino)methyl]-2-methoxyphenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [5-[(2-dimethylaminoethylamino)methyl]-2-methoxy-phenyl] ester Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNCC1=CC(=C(C=C1)OC)OS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CN(C)CCNCC1=CC(=C(C=C1)OC)OS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H26N2O5S/c1-21(2)12-11-20-14-15-5-10-18(25-4)19(13-15)26-27(22,23)17-8-6-16(24-3)7-9-17/h5-10,13,20H,11-12,14H2,1-4H3