2-[2-(2-iodanylphenyl)-2-oxidanyl-ethyl]-5-methyl-cyclohept-4-en-1-one

Systemtic Name: 2-[2-(2-iodanylphenyl)-2-oxidanyl-ethyl]-5-methyl-cyclohept-4-en-1-one Openeye Name: 2-[2-hydroxy-2-(2-iodophenyl)ethyl]-5-methyl-cyclohept-4-en-1-one CAS Name: 2-[2-hydroxy-2-(2-iodophenyl)ethyl]-5-methyl-1-cyclohept-4-enone IUPAC Name: 2-[2-hydroxy-2-(2-iodophenyl)ethyl]-5-methylcyclohept-4-en-1-one Traditional Name: 2-[2-hydroxy-2-(2-iodophenyl)ethyl]-5-methyl-cyclohept-4-en-1-one Formula: C16H19IO2 MolecularWeight: 370.22533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(=O)CC1)CC(C2=CC=CC=C2I)O

Isomeric SMILES

CC1=CCC(C(=O)CC1)CC(C2=CC=CC=C2I)O

InChI

InChI=1S/C16H19IO2/c1-11-6-8-12(15(18)9-7-11)10-16(19)13-4-2-3-5-14(13)17/h2-6,12,16,19H,7-10H2,1H3