methyl 2-[(2-iodanyl-3-methoxy-phenyl)methyl]-3,3-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: methyl 2-[(2-iodanyl-3-methoxy-phenyl)methyl]-3,3-dimethyl-4-oxidanylidene-butanoate Openeye Name: methyl 2-[(2-iodo-3-methoxy-phenyl)methyl]-3,3-dimethyl-4-oxo-butanoate CAS Name: 2-[(2-iodo-3-methoxyphenyl)methyl]-3,3-dimethyl-4-oxobutanoic acid methyl ester IUPAC Name: methyl 2-[(2-iodo-3-methoxyphenyl)methyl]-3,3-dimethyl-4-oxobutanoate Traditional Name: 2-(2-iodo-3-methoxy-benzyl)-4-keto-3,3-dimethyl-butyric acid methyl ester Formula: C15H19IO4 MolecularWeight: 390.21343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=O)C(CC1=C(C(=CC=C1)OC)I)C(=O)OC

Isomeric SMILES

CC(C)(C=O)C(CC1=C(C(=CC=C1)OC)I)C(=O)OC

InChI

InChI=1S/C15H19IO4/c1-15(2,9-17)11(14(18)20-4)8-10-6-5-7-12(19-3)13(10)16/h5-7,9,11H,8H2,1-4H3