(1E)-1-(5-oxidanylidene-2-phenyl-3,4-dihydropyran-1-ium-6-ylidene)pent-4-en-1-olate

Systemtic Name: (1E)-1-(5-oxidanylidene-2-phenyl-3,4-dihydropyran-1-ium-6-ylidene)pent-4-en-1-olate Openeye Name: (1E)-1-(5-oxo-2-phenyl-3,4-dihydropyran-1-ium-6-ylidene)pent-4-en-1-olate CAS Name: (1E)-1-(5-oxo-2-phenyl-3,4-dihydropyran-1-ium-6-ylidene)-4-penten-1-olate IUPAC Name: (1E)-1-(5-oxo-2-phenyl-3,4-dihydropyran-1-ium-6-ylidene)pent-4-en-1-olate Traditional Name: (1E)-1-(5-keto-2-phenyl-3,4-dihydropyran-1-ium-6-ylidene)pent-4-en-1-olate Formula: C16H16O3 MolecularWeight: 256.29644

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(=C1C(=O)CCC(=[O+]1)C2=CC=CC=C2)[O-]

Isomeric SMILES

C=CCC/C(=C\1/C(=O)CCC(=[O+]1)C2=CC=CC=C2)/[O-]

InChI

InChI=1S/C16H16O3/c1-2-3-9-13(17)16-14(18)10-11-15(19-16)12-7-5-4-6-8-12/h2,4-8H,1,3,9-11H2