(E)-2-diazonio-3-oxidanylidene-4-(4-oxidanylideneazetidin-2-yl)-1-phenylmethoxy-but-1-en-1-olate

Systemtic Name: (E)-2-diazonio-3-oxidanylidene-4-(4-oxidanylideneazetidin-2-yl)-1-phenylmethoxy-but-1-en-1-olate Openeye Name: (E)-1-benzyloxy-2-diazonio-3-oxo-4-(4-oxoazetidin-2-yl)but-1-en-1-olate CAS Name: (E)-2-diazonio-3-oxo-4-(4-oxo-2-azetidinyl)-1-phenylmethoxy-1-buten-1-olate IUPAC Name: (E)-2-diazonio-3-oxo-4-(4-oxoazetidin-2-yl)-1-phenylmethoxybut-1-en-1-olate Traditional Name: (E)-1-benzoxy-2-diazonio-3-keto-4-(4-ketoazetidin-2-yl)but-1-en-1-olate Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC1=O)CC(=O)C(=C([O-])OCC2=CC=CC=C2)[N+]#N

Isomeric SMILES

C1C(NC1=O)CC(=O)/C(=C(/[O-])\OCC2=CC=CC=C2)/[N+]#N

InChI

InChI=1S/C14H13N3O4/c15-17-13(11(18)6-10-7-12(19)16-10)14(20)21-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H-,16,18,19,20)