(4-methoxyphenyl)methyl 7-azido-3-methyl-3-oxidanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 7-azido-3-methyl-3-oxidanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 7-azido-3-hydroxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: 7-azido-3-hydroxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 7-azido-3-hydroxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: 7-azido-3-hydroxy-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid p-anisyl ester Formula: C16H18N4O5S MolecularWeight: 378.40292

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2C(C(=O)N2C1C(=O)OCC3=CC=C(C=C3)OC)N=[N+]=[N-])O

Isomeric SMILES

CC1(CSC2C(C(=O)N2C1C(=O)OCC3=CC=C(C=C3)OC)N=[N+]=[N-])O

InChI

InChI=1S/C16H18N4O5S/c1-16(23)8-26-14-11(18-19-17)13(21)20(14)12(16)15(22)25-7-9-3-5-10(24-2)6-4-9/h3-6,11-12,14,23H,7-8H2,1-2H3