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

Systemtic Name: (4-methoxyphenyl)methyl 7-azido-3-methyl-3-methylsulfonyloxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 7-azido-3-methyl-3-methylsulfonyloxy-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: 7-azido-3-methyl-3-methylsulfonyloxy-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-methyl-3-methylsulfonyloxy-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: 7-azido-8-keto-3-methyl-3-methylsulfonyloxy-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid p-anisyl ester Formula: C17H20N4O7S2 MolecularWeight: 456.4933

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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-])OS(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O7S2/c1-17(28-30(3,24)25)9-29-15-12(19-20-18)14(22)21(15)13(17)16(23)27-8-10-4-6-11(26-2)7-5-10/h4-7,12-13,15H,8-9H2,1-3H3