8-iodanyl-4-methyl-7-(2-oxidanylidenepropoxy)chromen-2-one

Systemtic Name: 8-iodanyl-4-methyl-7-(2-oxidanylidenepropoxy)chromen-2-one Openeye Name: 7-acetonyloxy-8-iodo-4-methyl-chromen-2-one CAS Name: 8-iodo-4-methyl-7-(2-oxopropoxy)-1-benzopyran-2-one IUPAC Name: 8-iodo-4-methyl-7-(2-oxopropoxy)chromen-2-one Traditional Name: 7-acetonyloxy-8-iodo-4-methyl-coumarin Formula: C13H11IO4 MolecularWeight: 358.12851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2I)OCC(=O)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2I)OCC(=O)C

InChI

InChI=1S/C13H11IO4/c1-7-5-11(16)18-13-9(7)3-4-10(12(13)14)17-6-8(2)15/h3-5H,6H2,1-2H3