methyl 3-(2-iodanylphenyl)-2-(2-oxidanylidenecyclohexyl)propanoate

Systemtic Name: methyl 3-(2-iodanylphenyl)-2-(2-oxidanylidenecyclohexyl)propanoate Openeye Name: methyl 3-(2-iodophenyl)-2-(2-oxocyclohexyl)propanoate CAS Name: 3-(2-iodophenyl)-2-(2-oxocyclohexyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2-iodophenyl)-2-(2-oxocyclohexyl)propanoate Traditional Name: 3-(2-iodophenyl)-2-(2-ketocyclohexyl)propionic acid methyl ester Formula: C16H19IO3 MolecularWeight: 386.22473

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1I)C2CCCCC2=O

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1I)C2CCCCC2=O

InChI

InChI=1S/C16H19IO3/c1-20-16(19)13(12-7-3-5-9-15(12)18)10-11-6-2-4-8-14(11)17/h2,4,6,8,12-13H,3,5,7,9-10H2,1H3