diphenyl 4-(phenylmethyl)pyrrole-1,3-disulfonate

Systemtic Name: diphenyl 4-(phenylmethyl)pyrrole-1,3-disulfonate Openeye Name: diphenyl 4-benzylpyrrole-1,3-disulfonate CAS Name: 4-(phenylmethyl)pyrrole-1,3-disulfonic acid diphenyl ester IUPAC Name: diphenyl 4-benzylpyrrole-1,3-disulfonate Traditional Name: 4-benzylpyrrole-1,3-disulfonic acid diphenyl ester Formula: C23H19NO6S2 MolecularWeight: 469.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN(C=C2S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN(C=C2S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C23H19NO6S2/c25-31(26,29-21-12-6-2-7-13-21)23-18-24(17-20(23)16-19-10-4-1-5-11-19)32(27,28)30-22-14-8-3-9-15-22/h1-15,17-18H,16H2