3-(3-acetamidopropyl)-6-methoxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(3-acetamidopropyl)-6-methoxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-(3-acetamidopropyl)-6-methoxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-(3-acetamidopropyl)-6-methoxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(3-acetamidopropyl)-6-methoxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-(3-acetamidopropyl)-7-keto-6-methoxy-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=C(N2C(S1)C(C2=O)OC)C(=O)O

Isomeric SMILES

CC(=O)NCCCC1=C(N2C(S1)C(C2=O)OC)C(=O)O

InChI

InChI=1S/C12H16N2O5S/c1-6(15)13-5-3-4-7-8(12(17)18)14-10(16)9(19-2)11(14)20-7/h9,11H,3-5H2,1-2H3,(H,13,15)(H,17,18)