(4-methoxyphenyl)methyl 6-(acetyloxymethyl)-6-bromanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 6-(acetyloxymethyl)-6-bromanyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 6-(acetoxymethyl)-6-bromo-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(acetyloxymethyl)-6-bromo-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 6-(acetyloxymethyl)-6-bromo-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(acetoxymethyl)-6-bromo-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid p-anisyl ester Formula: C17H16BrNO6S MolecularWeight: 442.28104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C2N(C1=O)C(=CS2)C(=O)OCC3=CC=C(C=C3)OC)Br

Isomeric SMILES

CC(=O)OCC1(C2N(C1=O)C(=CS2)C(=O)OCC3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C17H16BrNO6S/c1-10(20)25-9-17(18)15(22)19-13(8-26-16(17)19)14(21)24-7-11-3-5-12(23-2)6-4-11/h3-6,8,16H,7,9H2,1-2H3