methyl 2-[3,5-bis(bromanyl)-4-(3-iodanyl-4-methoxy-phenyl)sulfanyl-phenyl]ethanoate

Systemtic Name: methyl 2-[3,5-bis(bromanyl)-4-(3-iodanyl-4-methoxy-phenyl)sulfanyl-phenyl]ethanoate Openeye Name: methyl 2-[3,5-dibromo-4-(3-iodo-4-methoxy-phenyl)sulfanyl-phenyl]acetate CAS Name: 2-[3,5-dibromo-4-[(3-iodo-4-methoxyphenyl)thio]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3,5-dibromo-4-(3-iodo-4-methoxyphenyl)sulfanylphenyl]acetate Traditional Name: 2-[3,5-dibromo-4-[(3-iodo-4-methoxy-phenyl)thio]phenyl]acetic acid methyl ester Formula: C16H13Br2IO3S MolecularWeight: 572.05009

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SC2=C(C=C(C=C2Br)CC(=O)OC)Br)I

Isomeric SMILES

COC1=C(C=C(C=C1)SC2=C(C=C(C=C2Br)CC(=O)OC)Br)I

InChI

InChI=1S/C16H13Br2IO3S/c1-21-14-4-3-10(8-13(14)19)23-16-11(17)5-9(6-12(16)18)7-15(20)22-2/h3-6,8H,7H2,1-2H3