(1E)-1-diazonio-3-(5,5-dimethyl-4H-1,2-oxazol-3-yl)-3-methyl-octa-1,7-dien-2-olate

Systemtic Name: (1E)-1-diazonio-3-(5,5-dimethyl-4H-1,2-oxazol-3-yl)-3-methyl-octa-1,7-dien-2-olate Openeye Name: (1E)-1-diazonio-3-(5,5-dimethyl-4H-isoxazol-3-yl)-3-methyl-octa-1,7-dien-2-olate CAS Name: (1E)-1-diazonio-3-(5,5-dimethyl-4H-isoxazol-3-yl)-3-methyl-2-octa-1,7-dienolate IUPAC Name: (1E)-1-diazonio-3-(5,5-dimethyl-4H-1,2-oxazol-3-yl)-3-methylocta-1,7-dien-2-olate Traditional Name: (1E)-1-diazonio-3-(5,5-dimethyl-2-isoxazolin-3-yl)-3-methyl-octa-1,7-dien-2-olate Formula: C14H21N3O2 MolecularWeight: 263.33544

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NO1)C(C)(CCCC=C)C(=C[N+]#N)[O-])C

Isomeric SMILES

CC1(CC(=NO1)C(C)(CCCC=C)/C(=C\[N+]#N)/[O-])C

InChI

InChI=1S/C14H21N3O2/c1-5-6-7-8-14(4,12(18)10-16-15)11-9-13(2,3)19-17-11/h5,10H,1,6-9H2,2-4H3/b12-10+