(E)-1-diazonio-4-(2-oxidanylidenepiperidin-1-yl)but-1-en-2-olate

Systemtic Name: (E)-1-diazonio-4-(2-oxidanylidenepiperidin-1-yl)but-1-en-2-olate Openeye Name: (E)-1-diazonio-4-(2-oxo-1-piperidyl)but-1-en-2-olate CAS Name: (E)-1-diazonio-4-(2-oxo-1-piperidinyl)-1-buten-2-olate IUPAC Name: (E)-1-diazonio-4-(2-oxopiperidin-1-yl)but-1-en-2-olate Traditional Name: (E)-1-diazonio-4-(2-ketopiperidino)but-1-en-2-olate Formula: C9H13N3O2 MolecularWeight: 195.21842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)CCC(=C[N+]#N)[O-]

Isomeric SMILES

C1CCN(C(=O)C1)CC/C(=C\[N+]#N)/[O-]

InChI

InChI=1S/C9H13N3O2/c10-11-7-8(13)4-6-12-5-2-1-3-9(12)14/h7H,1-6H2/b8-7+