methyl 2-[2-bromanyl-6-[2-(1,3-dithian-2-yl)ethoxy]pyridin-4-yl]ethanoate

Systemtic Name: methyl 2-[2-bromanyl-6-[2-(1,3-dithian-2-yl)ethoxy]pyridin-4-yl]ethanoate Openeye Name: methyl 2-[2-bromo-6-[2-(1,3-dithian-2-yl)ethoxy]-4-pyridyl]acetate CAS Name: 2-[2-bromo-6-[2-(1,3-dithian-2-yl)ethoxy]-4-pyridinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-bromo-6-[2-(1,3-dithian-2-yl)ethoxy]pyridin-4-yl]acetate Traditional Name: 2-[2-bromo-6-[2-(1,3-dithian-2-yl)ethoxy]-4-pyridyl]acetic acid methyl ester Formula: C14H18BrNO3S2 MolecularWeight: 392.33162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=NC(=C1)Br)OCCC2SCCCS2

Isomeric SMILES

COC(=O)CC1=CC(=NC(=C1)Br)OCCC2SCCCS2

InChI

InChI=1S/C14H18BrNO3S2/c1-18-13(17)9-10-7-11(15)16-12(8-10)19-4-3-14-20-5-2-6-21-14/h7-8,14H,2-6,9H2,1H3