(2-azanylethylamino)methyl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (2-azanylethylamino)methyl 8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (2-aminoethylamino)methyl 8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2-aminoethylamino)methyl ester IUPAC Name: (2-aminoethylamino)methyl 8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2-aminoethylamino)methyl ester Formula: C10H15N3O3S MolecularWeight: 257.3094

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C(S1)CC2=O)C(=O)OCNCCN

Isomeric SMILES

C1C=C(N2C(S1)CC2=O)C(=O)OCNCCN

InChI

InChI=1S/C10H15N3O3S/c11-2-3-12-6-16-10(15)7-1-4-17-9-5-8(14)13(7)9/h1,9,12H,2-6,11H2