(E,4S)-4-[(3S)-3-azido-2-oxidanylidene-azetidin-1-yl]-2-diazonio-1-[(4-nitrophenyl)methoxy]-3-oxidanylidene-pent-1-en-1-olate

Systemtic Name: (E,4S)-4-[(3S)-3-azido-2-oxidanylidene-azetidin-1-yl]-2-diazonio-1-[(4-nitrophenyl)methoxy]-3-oxidanylidene-pent-1-en-1-olate Openeye Name: (E,4S)-4-[(3S)-3-azido-2-oxo-azetidin-1-yl]-2-diazonio-1-[(4-nitrophenyl)methoxy]-3-oxo-pent-1-en-1-olate CAS Name: (E,4S)-4-[(3S)-3-azido-2-oxo-1-azetidinyl]-2-diazonio-1-[(4-nitrophenyl)methoxy]-3-oxo-1-penten-1-olate IUPAC Name: (E,4S)-4-[(3S)-3-azido-2-oxoazetidin-1-yl]-2-diazonio-1-[(4-nitrophenyl)methoxy]-3-oxopent-1-en-1-olate Traditional Name: (E,4S)-4-[(3S)-3-azido-2-keto-azetidin-1-yl]-2-diazonio-3-keto-1-(4-nitrobenzyl)oxy-pent-1-en-1-olate Formula: C15H13N7O6 MolecularWeight: 387.30702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(=C([O-])OCC1=CC=C(C=C1)[N+](=O)[O-])[N+]#N)N2CC(C2=O)N=[N+]=[N-]

Isomeric SMILES

C[C@@H](C(=O)/C(=C(/[O-])\OCC1=CC=C(C=C1)[N+](=O)[O-])/[N+]#N)N2C[C@@H](C2=O)N=[N+]=[N-]

InChI

InChI=1S/C15H13N7O6/c1-8(21-6-11(14(21)24)19-20-17)13(23)12(18-16)15(25)28-7-9-2-4-10(5-3-9)22(26)27/h2-5,8,11H,6-7H2,1H3/t8-,11-/m0/s1