phenyl 2-(3-ethoxypiperazin-1-yl)-5-oxidanyl-benzenesulfonate

Systemtic Name: phenyl 2-(3-ethoxypiperazin-1-yl)-5-oxidanyl-benzenesulfonate Openeye Name: phenyl 2-(3-ethoxypiperazin-1-yl)-5-hydroxy-benzenesulfonate CAS Name: 2-(3-ethoxy-1-piperazinyl)-5-hydroxybenzenesulfonic acid phenyl ester IUPAC Name: phenyl 2-(3-ethoxypiperazin-1-yl)-5-hydroxybenzenesulfonate Traditional Name: 2-(3-ethoxypiperazino)-5-hydroxy-benzenesulfonic acid phenyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CCN1)C2=C(C=C(C=C2)O)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CCOC1CN(CCN1)C2=C(C=C(C=C2)O)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H22N2O5S/c1-2-24-18-13-20(11-10-19-18)16-9-8-14(21)12-17(16)26(22,23)25-15-6-4-3-5-7-15/h3-9,12,18-19,21H,2,10-11,13H2,1H3