(phenylmethyl) 4-ethyl-5-iodanyl-2-methanoyl-1H-pyrrole-3-carboxylate

Systemtic Name: (phenylmethyl) 4-ethyl-5-iodanyl-2-methanoyl-1H-pyrrole-3-carboxylate Openeye Name: benzyl 4-ethyl-2-formyl-5-iodo-1H-pyrrole-3-carboxylate CAS Name: 4-ethyl-2-formyl-5-iodo-1H-pyrrole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-ethyl-2-formyl-5-iodo-1H-pyrrole-3-carboxylate Traditional Name: 4-ethyl-2-formyl-5-iodo-1H-pyrrole-3-carboxylic acid benzyl ester Formula: C15H14INO3 MolecularWeight: 383.18103

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)OCC2=CC=CC=C2)C=O)I

Isomeric SMILES

CCC1=C(NC(=C1C(=O)OCC2=CC=CC=C2)C=O)I

InChI

InChI=1S/C15H14INO3/c1-2-11-13(12(8-18)17-14(11)16)15(19)20-9-10-6-4-3-5-7-10/h3-8,17H,2,9H2,1H3