1-(2-iodanyl-5-methoxy-phenyl)heptan-2-one

Systemtic Name: 1-(2-iodanyl-5-methoxy-phenyl)heptan-2-one Openeye Name: 1-(2-iodo-5-methoxy-phenyl)heptan-2-one CAS Name: 1-(2-iodo-5-methoxyphenyl)-2-heptanone IUPAC Name: 1-(2-iodo-5-methoxyphenyl)heptan-2-one Traditional Name: 1-(2-iodo-5-methoxy-phenyl)heptan-2-one Formula: C14H19IO2 MolecularWeight: 346.20393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19IO2/c1-3-4-5-6-12(16)9-11-10-13(17-2)7-8-14(11)15/h7-8,10H,3-6,9H2,1-2H3