ethyl 4-dodecanoyl-5-iodanyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-dodecanoyl-5-iodanyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-dodecanoyl-5-iodo-1H-pyrrole-2-carboxylate CAS Name: 5-iodo-4-(1-oxododecyl)-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-dodecanoyl-5-iodo-1H-pyrrole-2-carboxylate Traditional Name: 5-iodo-4-lauroyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C19H30INO3 MolecularWeight: 447.35087

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(NC(=C1)C(=O)OCC)I

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(NC(=C1)C(=O)OCC)I

InChI

InChI=1S/C19H30INO3/c1-3-5-6-7-8-9-10-11-12-13-17(22)15-14-16(21-18(15)20)19(23)24-4-2/h14,21H,3-13H2,1-2H3