phenyl 1-ethyl-4-propan-2-ylsulfonyl-pyrrole-3-sulfonate

Systemtic Name: phenyl 1-ethyl-4-propan-2-ylsulfonyl-pyrrole-3-sulfonate Openeye Name: phenyl 1-ethyl-4-isopropylsulfonyl-pyrrole-3-sulfonate CAS Name: 1-ethyl-4-propan-2-ylsulfonyl-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 1-ethyl-4-propan-2-ylsulfonylpyrrole-3-sulfonate Traditional Name: 1-ethyl-4-isopropylsulfonyl-pyrrole-3-sulfonic acid phenyl ester Formula: C15H19NO5S2 MolecularWeight: 357.44506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO5S2/c1-4-16-10-14(22(17,18)12(2)3)15(11-16)23(19,20)21-13-8-6-5-7-9-13/h5-12H,4H2,1-3H3