methyl 2-[5-iodanyl-2-methanoyl-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrol-3-yl]propanoate

Systemtic Name: methyl 2-[5-iodanyl-2-methanoyl-4-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrol-3-yl]propanoate Openeye Name: methyl 2-[2-formyl-5-iodo-4-(3-methoxy-3-oxo-propyl)-1H-pyrrol-3-yl]propanoate CAS Name: 2-[2-formyl-5-iodo-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 2-[2-formyl-5-iodo-4-(3-methoxy-3-oxopropyl)-1H-pyrrol-3-yl]propanoate Traditional Name: 2-[2-formyl-5-iodo-4-(3-keto-3-methoxy-propyl)-1H-pyrrol-3-yl]propionic acid methyl ester Formula: C13H16INO5 MolecularWeight: 393.17431

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(NC(=C1CCC(=O)OC)I)C=O)C(=O)OC

Isomeric SMILES

CC(C1=C(NC(=C1CCC(=O)OC)I)C=O)C(=O)OC

InChI

InChI=1S/C13H16INO5/c1-7(13(18)20-3)11-8(4-5-10(17)19-2)12(14)15-9(11)6-16/h6-7,15H,4-5H2,1-3H3