(2E)-2-[(Z)-3-methoxybut-2-enylidene]-3-oxidanylidene-4-phenyl-1,2-oxazol-2-ium-5-olate

Systemtic Name: (2E)-2-[(Z)-3-methoxybut-2-enylidene]-3-oxidanylidene-4-phenyl-1,2-oxazol-2-ium-5-olate Openeye Name: (2E)-2-[(Z)-3-methoxybut-2-enylidene]-3-oxo-4-phenyl-isoxazol-2-ium-5-olate CAS Name: (2E)-2-[(Z)-3-methoxybut-2-enylidene]-3-oxo-4-phenyl-5-isoxazol-2-iumolate IUPAC Name: (2E)-2-[(Z)-3-methoxybut-2-enylidene]-3-oxo-4-phenyl-1,2-oxazol-2-ium-5-olate Traditional Name: (2E)-3-keto-2-[(Z)-3-methoxybut-2-enylidene]-4-phenyl-4-isoxazolin-2-ium-5-olate Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=[N+]1C(=O)C(=C(O1)[O-])C2=CC=CC=C2)OC

Isomeric SMILES

C/C(=C/C=[N+]/1\C(=O)C(=C(O1)[O-])C2=CC=CC=C2)/OC

InChI

InChI=1S/C14H13NO4/c1-10(18-2)8-9-15-13(16)12(14(17)19-15)11-6-4-3-5-7-11/h3-9H,1-2H3/b10-8-,15-9+