diphenyl 4-(3-oxidanylpiperazin-1-yl)benzene-1,3-disulfonate

Systemtic Name: diphenyl 4-(3-oxidanylpiperazin-1-yl)benzene-1,3-disulfonate Openeye Name: diphenyl 4-(3-hydroxypiperazin-1-yl)benzene-1,3-disulfonate CAS Name: 4-(3-hydroxy-1-piperazinyl)benzene-1,3-disulfonic acid diphenyl ester IUPAC Name: diphenyl 4-(3-hydroxypiperazin-1-yl)benzene-1,3-disulfonate Traditional Name: 4-(3-hydroxypiperazino)benzene-1,3-disulfonic acid diphenyl ester Formula: C22H22N2O7S2 MolecularWeight: 490.54928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)O)C2=C(C=C(C=C2)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CN(CC(N1)O)C2=C(C=C(C=C2)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O7S2/c25-22-16-24(14-13-23-22)20-12-11-19(32(26,27)30-17-7-3-1-4-8-17)15-21(20)33(28,29)31-18-9-5-2-6-10-18/h1-12,15,22-23,25H,13-14,16H2