phenyl 4-methoxy-1-(2-methylpropyl)pyrrole-3-sulfonate

Systemtic Name: phenyl 4-methoxy-1-(2-methylpropyl)pyrrole-3-sulfonate Openeye Name: phenyl 1-isobutyl-4-methoxy-pyrrole-3-sulfonate CAS Name: 4-methoxy-1-(2-methylpropyl)-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 4-methoxy-1-(2-methylpropyl)pyrrole-3-sulfonate Traditional Name: 1-isobutyl-4-methoxy-pyrrole-3-sulfonic acid phenyl ester Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=C1)S(=O)(=O)OC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)CN1C=C(C(=C1)S(=O)(=O)OC2=CC=CC=C2)OC

InChI

InChI=1S/C15H19NO4S/c1-12(2)9-16-10-14(19-3)15(11-16)21(17,18)20-13-7-5-4-6-8-13/h4-8,10-12H,9H2,1-3H3