methyl 4-[5-iodanyl-2,3-bis(oxidanylidene)indol-1-yl]butanoate

Systemtic Name: methyl 4-[5-iodanyl-2,3-bis(oxidanylidene)indol-1-yl]butanoate Openeye Name: methyl 4-(5-iodo-2,3-dioxo-indolin-1-yl)butanoate CAS Name: 4-(5-iodo-2,3-dioxo-1-indolyl)butanoic acid methyl ester IUPAC Name: methyl 4-(5-iodo-2,3-dioxoindol-1-yl)butanoate Traditional Name: 4-(5-iodo-2,3-diketo-indolin-1-yl)butyric acid methyl ester Formula: C13H12INO4 MolecularWeight: 373.14315

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN1C2=C(C=C(C=C2)I)C(=O)C1=O

Isomeric SMILES

COC(=O)CCCN1C2=C(C=C(C=C2)I)C(=O)C1=O

InChI

InChI=1S/C13H12INO4/c1-19-11(16)3-2-6-15-10-5-4-8(14)7-9(10)12(17)13(15)18/h4-5,7H,2-3,6H2,1H3