(4-nitrophenyl)methyl 3-(1-azido-2-methyl-propan-2-yl)-7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-(1-azido-2-methyl-propan-2-yl)-7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-(2-azido-1,1-dimethyl-ethyl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-(1-azido-2-methylpropan-2-yl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-(1-azido-2-methylpropan-2-yl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-(2-azido-1,1-dimethyl-ethyl)-7-keto-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (4-nitrobenzyl) ester Formula: C17H17N5O6 MolecularWeight: 387.34678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN=[N+]=[N-])C1=C(N2C(O1)CC2=O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CN=[N+]=[N-])C1=C(N2C(O1)CC2=O)C(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O6/c1-17(2,9-19-20-18)15-14(21-12(23)7-13(21)28-15)16(24)27-8-10-3-5-11(6-4-10)22(25)26/h3-6,13H,7-9H2,1-2H3