phenyl 1,4-bis(phenylmethyl)pyrrole-3-sulfonate

Systemtic Name: phenyl 1,4-bis(phenylmethyl)pyrrole-3-sulfonate Openeye Name: phenyl 1,4-dibenzylpyrrole-3-sulfonate CAS Name: 1,4-bis(phenylmethyl)-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 1,4-dibenzylpyrrole-3-sulfonate Traditional Name: 1,4-dibenzylpyrrole-3-sulfonic acid phenyl ester Formula: C24H21NO3S MolecularWeight: 403.49344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN(C=C2S(=O)(=O)OC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN(C=C2S(=O)(=O)OC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H21NO3S/c26-29(27,28-23-14-8-3-9-15-23)24-19-25(17-21-12-6-2-7-13-21)18-22(24)16-20-10-4-1-5-11-20/h1-15,18-19H,16-17H2