(E)-[(5E)-5-(2-but-3-enoxy-1-diazonio-2-oxidanylidene-ethylidene)-2-methyl-1,3-oxazol-4-ylidene]-methoxy-methanolate

Systemtic Name: (E)-[(5E)-5-(2-but-3-enoxy-1-diazonio-2-oxidanylidene-ethylidene)-2-methyl-1,3-oxazol-4-ylidene]-methoxy-methanolate Openeye Name: (E)-[(5E)-5-(2-but-3-enoxy-1-diazonio-2-oxo-ethylidene)-2-methyl-oxazol-4-ylidene]-methoxy-methanolate CAS Name: (E)-[(5E)-5-(2-but-3-enoxy-1-diazonio-2-oxoethylidene)-2-methyl-4-oxazolylidene]-methoxymethanolate IUPAC Name: (E)-[(5E)-5-(2-but-3-enoxy-1-diazonio-2-oxoethylidene)-2-methyl-1,3-oxazol-4-ylidene]-methoxymethanolate Traditional Name: (E)-[(5E)-5-(2-but-3-enoxy-1-diazonio-2-keto-ethylidene)-2-methyl-2-oxazolin-4-ylidene]-methoxy-methanolate Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C([O-])OC)C(=C(C(=O)OCCC=C)[N+]#N)O1

Isomeric SMILES

CC1=N/C(=C(\[O-])/OC)/C(=C(/C(=O)OCCC=C)\[N+]#N)/O1

InChI

InChI=1S/C12H13N3O5/c1-4-5-6-19-12(17)9(15-13)10-8(11(16)18-3)14-7(2)20-10/h4H,1,5-6H2,2-3H3