(3-iodanylphenyl) 1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxylate

Systemtic Name: (3-iodanylphenyl) 1-methyl-4-morpholin-4-ylsulfonyl-pyrrole-2-carboxylate Openeye Name: (3-iodophenyl) 1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolecarboxylic acid (3-iodophenyl) ester IUPAC Name: (3-iodophenyl) 1-methyl-4-morpholin-4-ylsulfonylpyrrole-2-carboxylate Traditional Name: 1-methyl-4-morpholinosulfonyl-pyrrole-2-carboxylic acid (3-iodophenyl) ester Formula: C16H17IN2O5S MolecularWeight: 476.28605

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=CC(=CC=C2)I)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=CC(=CC=C2)I)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H17IN2O5S/c1-18-11-14(25(21,22)19-5-7-23-8-6-19)10-15(18)16(20)24-13-4-2-3-12(17)9-13/h2-4,9-11H,5-8H2,1H3