methyl 2-[2-(5-iodanylthiophen-2-yl)ethyl]-6-methoxy-benzoate

Systemtic Name: methyl 2-[2-(5-iodanylthiophen-2-yl)ethyl]-6-methoxy-benzoate Openeye Name: methyl 2-[2-(5-iodo-2-thienyl)ethyl]-6-methoxy-benzoate CAS Name: 2-[2-(5-iodo-2-thiophenyl)ethyl]-6-methoxybenzoic acid methyl ester IUPAC Name: methyl 2-[2-(5-iodothiophen-2-yl)ethyl]-6-methoxybenzoate Traditional Name: 2-[2-(5-iodo-2-thienyl)ethyl]-6-methoxy-benzoic acid methyl ester Formula: C15H15IO3S MolecularWeight: 402.24727

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C(=O)OC)CCC2=CC=C(S2)I

Isomeric SMILES

COC1=CC=CC(=C1C(=O)OC)CCC2=CC=C(S2)I

InChI

InChI=1S/C15H15IO3S/c1-18-12-5-3-4-10(14(12)15(17)19-2)6-7-11-8-9-13(16)20-11/h3-5,8-9H,6-7H2,1-2H3