7-azanyl-8-oxidanylidene-3-propyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-8-oxidanylidene-3-propyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-8-oxo-3-propyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-8-oxo-3-propyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-8-oxo-3-propyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-8-keto-3-propyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C10H14N2O3S MolecularWeight: 242.29476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N2C(C(C2=O)N)SC1)C(=O)O

Isomeric SMILES

CCCC1=C(N2C(C(C2=O)N)SC1)C(=O)O

InChI

InChI=1S/C10H14N2O3S/c1-2-3-5-4-16-9-6(11)8(13)12(9)7(5)10(14)15/h6,9H,2-4,11H2,1H3,(H,14,15)