tert-butyl 7-azanyl-3-ethanoyl-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: tert-butyl 7-azanyl-3-ethanoyl-7-methoxy-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: tert-butyl 3-acetyl-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-acetyl-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-acetyl-7-amino-7-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-acetyl-7-amino-8-keto-7-methoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid tert-butyl ester Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N2C(C(C2=O)(N)OC)SC1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C1=C(N2C(C(C2=O)(N)OC)SC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H20N2O5S/c1-7(17)8-6-22-12-14(15,20-5)11(19)16(12)9(8)10(18)21-13(2,3)4/h12H,6,15H2,1-5H3