phenyl 1-ethyl-4-(phenylsulfonyl)pyrrole-3-sulfonate

Systemtic Name: phenyl 1-ethyl-4-(phenylsulfonyl)pyrrole-3-sulfonate Openeye Name: phenyl 4-(benzenesulfonyl)-1-ethyl-pyrrole-3-sulfonate CAS Name: 4-(benzenesulfonyl)-1-ethyl-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 4-(benzenesulfonyl)-1-ethylpyrrole-3-sulfonate Traditional Name: 4-besyl-1-ethyl-pyrrole-3-sulfonic acid phenyl ester Formula: C18H17NO5S2 MolecularWeight: 391.46128

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=C1)S(=O)(=O)OC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C=C(C(=C1)S(=O)(=O)OC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17NO5S2/c1-2-19-13-17(25(20,21)16-11-7-4-8-12-16)18(14-19)26(22,23)24-15-9-5-3-6-10-15/h3-14H,2H2,1H3