phenyl 4-oxidanyl-1-(phenylmethyl)pyrrole-3-sulfonate

Systemtic Name: phenyl 4-oxidanyl-1-(phenylmethyl)pyrrole-3-sulfonate Openeye Name: phenyl 1-benzyl-4-hydroxy-pyrrole-3-sulfonate CAS Name: 4-hydroxy-1-(phenylmethyl)-3-pyrrolesulfonic acid phenyl ester IUPAC Name: phenyl 1-benzyl-4-hydroxypyrrole-3-sulfonate Traditional Name: 1-benzyl-4-hydroxy-pyrrole-3-sulfonic acid phenyl ester Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=C2)S(=O)(=O)OC3=CC=CC=C3)O

InChI

InChI=1S/C17H15NO4S/c19-16-12-18(11-14-7-3-1-4-8-14)13-17(16)23(20,21)22-15-9-5-2-6-10-15/h1-10,12-13,19H,11H2