2-[2-(4-iodanylbutyl)-2-methyl-4-oxidanylidene-3H-chromen-7-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[2-(4-iodanylbutyl)-2-methyl-4-oxidanylidene-3H-chromen-7-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-(4-iodobutyl)-2-methyl-4-oxo-chroman-7-yl]-2-oxo-acetic acid CAS Name: 2-[2-(4-iodobutyl)-2-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl]-2-oxoacetic acid IUPAC Name: 2-[2-(4-iodobutyl)-2-methyl-4-oxo-3H-chromen-7-yl]-2-oxoacetic acid Traditional Name: 2-[2-(4-iodobutyl)-4-keto-2-methyl-chroman-7-yl]-2-keto-acetic acid Formula: C16H17IO5 MolecularWeight: 416.20765

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(O1)C=C(C=C2)C(=O)C(=O)O)CCCCI

Isomeric SMILES

CC1(CC(=O)C2=C(O1)C=C(C=C2)C(=O)C(=O)O)CCCCI

InChI

InChI=1S/C16H17IO5/c1-16(6-2-3-7-17)9-12(18)11-5-4-10(8-13(11)22-16)14(19)15(20)21/h4-5,8H,2-3,6-7,9H2,1H3,(H,20,21)