methyl 2-(4-iodanyl-1-methoxy-1H-isochromen-3-yl)benzoate

Systemtic Name: methyl 2-(4-iodanyl-1-methoxy-1H-isochromen-3-yl)benzoate Openeye Name: methyl 2-(4-iodo-1-methoxy-1H-isochromen-3-yl)benzoate CAS Name: 2-(4-iodo-1-methoxy-1H-2-benzopyran-3-yl)benzoic acid methyl ester IUPAC Name: methyl 2-(4-iodo-1-methoxy-1H-isochromen-3-yl)benzoate Traditional Name: 2-(4-iodo-1-methoxy-1H-isochromen-3-yl)benzoic acid methyl ester Formula: C18H15IO4 MolecularWeight: 422.21377

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2=CC=CC=C2C(=C(O1)C3=CC=CC=C3C(=O)OC)I

Isomeric SMILES

COC1C2=CC=CC=C2C(=C(O1)C3=CC=CC=C3C(=O)OC)I

InChI

InChI=1S/C18H15IO4/c1-21-17(20)13-9-5-4-8-12(13)16-15(19)11-7-3-6-10-14(11)18(22-2)23-16/h3-10,18H,1-2H3