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

Systemtic Name: phenyl 3-ethoxy-4-propan-2-ylsulfonyl-pyrrole-1-sulfonate Openeye Name: phenyl 3-ethoxy-4-isopropylsulfonyl-pyrrole-1-sulfonate CAS Name: 3-ethoxy-4-propan-2-ylsulfonyl-1-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 3-ethoxy-4-propan-2-ylsulfonylpyrrole-1-sulfonate Traditional Name: 3-ethoxy-4-isopropylsulfonyl-pyrrole-1-sulfonic acid phenyl ester Formula: C15H19NO6S2 MolecularWeight: 373.44446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO6S2/c1-4-21-14-10-16(11-15(14)23(17,18)12(2)3)24(19,20)22-13-8-6-5-7-9-13/h5-12H,4H2,1-3H3