(E)-methoxy-(2-naphthalen-1-yl-4-oxidanylidene-3-phenyl-1,3-oxazol-3-ium-5-ylidene)methanolate

Systemtic Name: (E)-methoxy-(2-naphthalen-1-yl-4-oxidanylidene-3-phenyl-1,3-oxazol-3-ium-5-ylidene)methanolate Openeye Name: (E)-methoxy-[2-(1-naphthyl)-4-oxo-3-phenyl-oxazol-3-ium-5-ylidene]methanolate CAS Name: (E)-methoxy-[2-(1-naphthalenyl)-4-oxo-3-phenyl-5-oxazol-3-iumylidene]methanolate IUPAC Name: (E)-methoxy-(2-naphthalen-1-yl-4-oxo-3-phenyl-1,3-oxazol-3-ium-5-ylidene)methanolate Traditional Name: (E)-[4-keto-2-(1-naphthyl)-3-phenyl-2-oxazolin-3-ium-5-ylidene]-methoxy-methanolate Formula: C21H15NO4 MolecularWeight: 345.3481

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C1C(=O)[N+](=C(O1)C2=CC=CC3=CC=CC=C32)C4=CC=CC=C4)[O-]

Isomeric SMILES

CO/C(=C/1\C(=O)[N+](=C(O1)C2=CC=CC3=CC=CC=C32)C4=CC=CC=C4)/[O-]

InChI

InChI=1S/C21H15NO4/c1-25-21(24)18-19(23)22(15-10-3-2-4-11-15)20(26-18)17-13-7-9-14-8-5-6-12-16(14)17/h2-13H,1H3