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

Systemtic Name: phenyl 3-ethoxy-4-(phenylsulfonyl)pyrrole-1-sulfonate Openeye Name: phenyl 3-(benzenesulfonyl)-4-ethoxy-pyrrole-1-sulfonate CAS Name: 3-(benzenesulfonyl)-4-ethoxy-1-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 3-(benzenesulfonyl)-4-ethoxypyrrole-1-sulfonate Traditional Name: 3-besyl-4-ethoxy-pyrrole-1-sulfonic acid phenyl ester Formula: C18H17NO6S2 MolecularWeight: 407.46068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(C=C1S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CCOC1=CN(C=C1S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C18H17NO6S2/c1-2-24-17-13-19(27(22,23)25-15-9-5-3-6-10-15)14-18(17)26(20,21)16-11-7-4-8-12-16/h3-14H,2H2,1H3