4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one Formula: C18H15N2O2+ MolecularWeight: 291.3239

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CNC(=C3C=CC(=O)C=C3)C=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CNC(=C3C=CC(=O)C=C3)C=C2

InChI

InChI=1S/C18H14N2O2/c21-16-8-6-14(7-9-16)17-10-11-20(13-19-17)12-18(22)15-4-2-1-3-5-15/h1-11,13H,12H2/p+1