2-iodanyl-4-oxidanylidene-4-prop-2-ynoxy-butanoic acid

Systemtic Name: 2-iodanyl-4-oxidanylidene-4-prop-2-ynoxy-butanoic acid Openeye Name: 2-iodo-4-oxo-4-prop-2-ynoxy-butanoic acid CAS Name: 2-iodo-4-oxo-4-prop-2-ynoxybutanoic acid IUPAC Name: 2-iodo-4-oxo-4-prop-2-ynoxybutanoic acid Traditional Name: 2-iodo-4-keto-4-propargyloxy-butyric acid Formula: C7H7IO4 MolecularWeight: 282.03255

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)CC(C(=O)O)I

Isomeric SMILES

C#CCOC(=O)CC(C(=O)O)I

InChI

InChI=1S/C7H7IO4/c1-2-3-12-6(9)4-5(8)7(10)11/h1,5H,3-4H2,(H,10,11)