phenethyl 3-iodanyl-4-methoxy-benzoate

Systemtic Name: phenethyl 3-iodanyl-4-methoxy-benzoate Openeye Name: phenethyl 3-iodo-4-methoxy-benzoate CAS Name: 3-iodo-4-methoxybenzoic acid phenethyl ester IUPAC Name: phenethyl 3-iodo-4-methoxybenzoate Traditional Name: 3-iodo-4-methoxy-benzoic acid phenethyl ester Formula: C16H15IO3 MolecularWeight: 382.19297

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCCC2=CC=CC=C2)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCCC2=CC=CC=C2)I

InChI

InChI=1S/C16H15IO3/c1-19-15-8-7-13(11-14(15)17)16(18)20-10-9-12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3