pentyl 7-azanyl-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: pentyl 7-azanyl-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: pentyl 7-amino-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid pentyl ester IUPAC Name: pentyl 7-amino-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-8-keto-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid amyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(CSC2N1C(=O)C2N)C=C

Isomeric SMILES

CCCCCOC(=O)C1=C(CSC2N1C(=O)C2N)C=C

InChI

InChI=1S/C14H20N2O3S/c1-3-5-6-7-19-14(18)11-9(4-2)8-20-13-10(15)12(17)16(11)13/h4,10,13H,2-3,5-8,15H2,1H3