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

Systemtic Name: methyl 3-[5-iodanyl-4-(2-methoxy-2-oxidanylidene-ethyl)-2-methyl-1H-pyrrol-3-yl]propanoate Openeye Name: methyl 3-[5-iodo-4-(2-methoxy-2-oxo-ethyl)-2-methyl-1H-pyrrol-3-yl]propanoate CAS Name: 3-[5-iodo-4-(2-methoxy-2-oxoethyl)-2-methyl-1H-pyrrol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-iodo-4-(2-methoxy-2-oxoethyl)-2-methyl-1H-pyrrol-3-yl]propanoate Traditional Name: 3-[5-iodo-4-(2-keto-2-methoxy-ethyl)-2-methyl-1H-pyrrol-3-yl]propionic acid methyl ester Formula: C12H16INO4 MolecularWeight: 365.16421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)I)CC(=O)OC)CCC(=O)OC

Isomeric SMILES

CC1=C(C(=C(N1)I)CC(=O)OC)CCC(=O)OC

InChI

InChI=1S/C12H16INO4/c1-7-8(4-5-10(15)17-2)9(12(13)14-7)6-11(16)18-3/h14H,4-6H2,1-3H3