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

Systemtic Name: phenyl 3-(3-ethoxypiperazin-1-yl)-4-[(2-hydroxyphenyl)sulfonylamino]benzenesulfonate Openeye Name: phenyl 3-(3-ethoxypiperazin-1-yl)-4-[(2-hydroxyphenyl)sulfonylamino]benzenesulfonate CAS Name: 3-(3-ethoxy-1-piperazinyl)-4-[(2-hydroxyphenyl)sulfonylamino]benzenesulfonic acid phenyl ester IUPAC Name: phenyl 3-(3-ethoxypiperazin-1-yl)-4-[(2-hydroxyphenyl)sulfonylamino]benzenesulfonate Traditional Name: 3-(3-ethoxypiperazino)-4-[(2-hydroxyphenyl)sulfonylamino]benzenesulfonic acid phenyl ester Formula: C24H27N3O7S2 MolecularWeight: 533.61708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O7S2/c1-2-33-24-17-27(15-14-25-24)21-16-19(36(31,32)34-18-8-4-3-5-9-18)12-13-20(21)26-35(29,30)23-11-7-6-10-22(23)28/h3-13,16,24-26,28H,2,14-15,17H2,1H3