[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 3-iodanylbenzoate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 3-iodanylbenzoate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C16H13IO4 MolecularWeight: 396.17649

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13IO4/c1-20-14-7-3-4-11(9-14)15(18)10-21-16(19)12-5-2-6-13(17)8-12/h2-9H,10H2,1H3