ethylsulfinyl 3-[(4-nitrophenyl)methyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: ethylsulfinyl 3-[(4-nitrophenyl)methyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: ethylsulfinyl 3-[(4-nitrophenyl)methyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-[(4-nitrophenyl)methyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid ethylsulfinyl ester IUPAC Name: ethylsulfinyl 3-[(4-nitrophenyl)methyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-3-(4-nitrobenzyl)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid ethylsulfinyl ester Formula: C16H16N2O6S MolecularWeight: 364.37304

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)OC(=O)C1=C(CC2N1C(=O)C2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)OC(=O)C1=C(CC2N1C(=O)C2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O6S/c1-2-25(23)24-16(20)15-11(8-13-9-14(19)17(13)15)7-10-3-5-12(6-4-10)18(21)22/h3-6,13H,2,7-9H2,1H3