[(1S,6R)-6-azido-2-oxidanylidene-cyclohex-3-en-1-yl] benzoate

Systemtic Name: [(1S,6R)-6-azido-2-oxidanylidene-cyclohex-3-en-1-yl] benzoate Openeye Name: [(1S,6R)-6-azido-2-oxo-cyclohex-3-en-1-yl] benzoate CAS Name: benzoic acid [(1S,6R)-6-azido-2-oxo-1-cyclohex-3-enyl] ester IUPAC Name: [(1S,6R)-6-azido-2-oxocyclohex-3-en-1-yl] benzoate Traditional Name: benzoic acid [(1S,6R)-6-azido-2-keto-cyclohex-3-en-1-yl] ester Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=O)C(C1N=[N+]=[N-])OC(=O)C2=CC=CC=C2

Isomeric SMILES

C1C=CC(=O)[C@H]([C@@H]1N=[N+]=[N-])OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H11N3O3/c14-16-15-10-7-4-8-11(17)12(10)19-13(18)9-5-2-1-3-6-9/h1-6,8,10,12H,7H2/t10-,12+/m1/s1