methyl 3-iodanyl-4-methyl-benzoate

Systemtic Name: methyl 3-iodanyl-4-methyl-benzoate Openeye Name: methyl 3-iodo-4-methyl-benzoate CAS Name: 3-iodo-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-iodo-4-methylbenzoate Traditional Name: 3-iodo-4-methyl-benzoic acid methyl ester Formula: C9H9IO2 MolecularWeight: 276.07103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9IO2/c1-6-3-4-7(5-8(6)10)9(11)12-2/h3-5H,1-2H3