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

Systemtic Name: phenyl 3-methoxy-4-propan-2-ylsulfonyl-pyrrole-1-sulfonate Openeye Name: phenyl 3-isopropylsulfonyl-4-methoxy-pyrrole-1-sulfonate CAS Name: 3-methoxy-4-propan-2-ylsulfonyl-1-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 3-methoxy-4-propan-2-ylsulfonylpyrrole-1-sulfonate Traditional Name: 3-isopropylsulfonyl-4-methoxy-pyrrole-1-sulfonic acid phenyl ester Formula: C14H17NO6S2 MolecularWeight: 359.41788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CN(C=C1OC)S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(C)S(=O)(=O)C1=CN(C=C1OC)S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C14H17NO6S2/c1-11(2)22(16,17)14-10-15(9-13(14)20-3)23(18,19)21-12-7-5-4-6-8-12/h4-11H,1-3H3