(Z)-2-diazonio-1-(3-methyl-5-pent-4-ynoxycarbonyl-1,2-oxazol-4-yl)ethenolate

Systemtic Name: (Z)-2-diazonio-1-(3-methyl-5-pent-4-ynoxycarbonyl-1,2-oxazol-4-yl)ethenolate Openeye Name: (Z)-2-diazonio-1-(3-methyl-5-pent-4-ynoxycarbonyl-isoxazol-4-yl)ethenolate CAS Name: (Z)-2-diazonio-1-[3-methyl-5-[oxo(pent-4-ynoxy)methyl]-4-isoxazolyl]ethenolate IUPAC Name: (Z)-2-diazonio-1-(3-methyl-5-pent-4-ynoxycarbonyl-1,2-oxazol-4-yl)ethenolate Traditional Name: (Z)-2-diazonio-1-(3-methyl-5-pent-4-ynoxycarbonyl-isoxazol-4-yl)ethenolate Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=C[N+]#N)[O-])C(=O)OCCCC#C

Isomeric SMILES

CC1=NOC(=C1/C(=C/[N+]#N)/[O-])C(=O)OCCCC#C

InChI

InChI=1S/C12H11N3O4/c1-3-4-5-6-18-12(17)11-10(8(2)15-19-11)9(16)7-14-13/h1,7H,4-6H2,2H3/b9-7-