(4-methoxyphenyl)methyl 2-(3-bromanyl-2-oxidanylidene-4-sulfanyl-azetidin-1-yl)ethanoate

Systemtic Name: (4-methoxyphenyl)methyl 2-(3-bromanyl-2-oxidanylidene-4-sulfanyl-azetidin-1-yl)ethanoate Openeye Name: (4-methoxyphenyl)methyl 2-(3-bromo-2-oxo-4-sulfanyl-azetidin-1-yl)acetate CAS Name: 2-(3-bromo-2-mercapto-4-oxo-1-azetidinyl)acetic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-(3-bromo-2-oxo-4-sulfanylazetidin-1-yl)acetate Traditional Name: 2-(3-bromo-2-keto-4-mercapto-azetidin-1-yl)acetic acid p-anisyl ester Formula: C13H14BrNO4S MolecularWeight: 360.22356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC(=O)CN2C(C(C2=O)Br)S

Isomeric SMILES

COC1=CC=C(C=C1)COC(=O)CN2C(C(C2=O)Br)S

InChI

InChI=1S/C13H14BrNO4S/c1-18-9-4-2-8(3-5-9)7-19-10(16)6-15-12(17)11(14)13(15)20/h2-5,11,13,20H,6-7H2,1H3