methyl 2-[(2-iodanylphenyl)methyl]-5-methyl-4-oxidanylidene-hexanoate

Systemtic Name: methyl 2-[(2-iodanylphenyl)methyl]-5-methyl-4-oxidanylidene-hexanoate Openeye Name: methyl 2-[(2-iodophenyl)methyl]-5-methyl-4-oxo-hexanoate CAS Name: 2-[(2-iodophenyl)methyl]-5-methyl-4-oxohexanoic acid methyl ester IUPAC Name: methyl 2-[(2-iodophenyl)methyl]-5-methyl-4-oxohexanoate Traditional Name: 2-(2-iodobenzyl)-4-keto-5-methyl-hexanoic acid methyl ester Formula: C15H19IO3 MolecularWeight: 374.21403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CC(CC1=CC=CC=C1I)C(=O)OC

Isomeric SMILES

CC(C)C(=O)CC(CC1=CC=CC=C1I)C(=O)OC

InChI

InChI=1S/C15H19IO3/c1-10(2)14(17)9-12(15(18)19-3)8-11-6-4-5-7-13(11)16/h4-7,10,12H,8-9H2,1-3H3