4-[(4-methoxyphenoxy)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 4-[(4-methoxyphenoxy)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 4-[(4-methoxyphenoxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 4-[(4-methoxyphenoxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 4-[(4-methoxyphenoxy)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-4-[(4-methoxyphenoxy)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2C=C(N3C(S2)CC3=O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)OCC2C=C(N3C(S2)CC3=O)C(=O)O

InChI

InChI=1S/C15H15NO5S/c1-20-9-2-4-10(5-3-9)21-8-11-6-12(15(18)19)16-13(17)7-14(16)22-11/h2-6,11,14H,7-8H2,1H3,(H,18,19)