(4-nitrophenyl)methyl 6-ethyl-7-oxidanylidene-3-sulfanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 6-ethyl-7-oxidanylidene-3-sulfanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 6-ethyl-7-oxo-3-thioxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-ethyl-7-oxo-3-sulfanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 6-ethyl-7-oxo-3-sulfanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-ethyl-7-keto-3-thioxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (4-nitrobenzyl) ester Formula: C15H14N2O5S2 MolecularWeight: 366.41206

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2N(C1=O)C(C(=S)S2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1C2N(C1=O)C(C(=S)S2)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O5S2/c1-2-10-12(18)16-11(15(23)24-13(10)16)14(19)22-7-8-3-5-9(6-4-8)17(20)21/h3-6,10-11,13H,2,7H2,1H3