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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

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