phenyl 4-ethoxy-1-methyl-pyrrole-3-sulfonate

Systemtic Name: phenyl 4-ethoxy-1-methyl-pyrrole-3-sulfonate Openeye Name: phenyl 4-ethoxy-1-methyl-pyrrole-3-sulfonate CAS Name: 4-ethoxy-1-methyl-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 4-ethoxy-1-methylpyrrole-3-sulfonate Traditional Name: 4-ethoxy-1-methyl-pyrrole-3-sulfonic acid phenyl ester Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CN(C=C1S(=O)(=O)OC2=CC=CC=C2)C

Isomeric SMILES

CCOC1=CN(C=C1S(=O)(=O)OC2=CC=CC=C2)C

InChI

InChI=1S/C13H15NO4S/c1-3-17-12-9-14(2)10-13(12)19(15,16)18-11-7-5-4-6-8-11/h4-10H,3H2,1-2H3