phenyl 4-(3-ethoxypiperazin-1-yl)-3-(2-hydroxyphenyl)benzenesulfonate

Systemtic Name: phenyl 4-(3-ethoxypiperazin-1-yl)-3-(2-hydroxyphenyl)benzenesulfonate Openeye Name: phenyl 4-(3-ethoxypiperazin-1-yl)-3-(2-hydroxyphenyl)benzenesulfonate CAS Name: 4-(3-ethoxy-1-piperazinyl)-3-(2-hydroxyphenyl)benzenesulfonic acid phenyl ester IUPAC Name: phenyl 4-(3-ethoxypiperazin-1-yl)-3-(2-hydroxyphenyl)benzenesulfonate Traditional Name: 4-(3-ethoxypiperazino)-3-(2-hydroxyphenyl)benzenesulfonic acid phenyl ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CCN1)C2=C(C=C(C=C2)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CCOC1CN(CCN1)C2=C(C=C(C=C2)S(=O)(=O)OC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C24H26N2O5S/c1-2-30-24-17-26(15-14-25-24)22-13-12-19(16-21(22)20-10-6-7-11-23(20)27)32(28,29)31-18-8-4-3-5-9-18/h3-13,16,24-25,27H,2,14-15,17H2,1H3