(phenylmethyl) 2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxy-pyrrole-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxy-pyrrole-1-carboxylate Openeye Name: benzyl 2-(hydroxymethyl)-4-(p-tolylsulfonyloxy)pyrrole-1-carboxylate CAS Name: 2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxy-1-pyrrolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(hydroxymethyl)-4-(4-methylphenyl)sulfonyloxypyrrole-1-carboxylate Traditional Name: 2-methylol-4-tosyloxy-pyrrole-1-carboxylic acid benzyl ester Formula: C20H19NO6S MolecularWeight: 401.43296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CN(C(=C2)CO)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CN(C(=C2)CO)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H19NO6S/c1-15-7-9-19(10-8-15)28(24,25)27-18-11-17(13-22)21(12-18)20(23)26-14-16-5-3-2-4-6-16/h2-12,22H,13-14H2,1H3