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

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

Systemtic Name:4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one bromide
Openeye Name:4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one bromide
CAS Name:4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)-1-cyclohexa-2,5-dienone bromide
IUPAC Name:4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one bromide
Traditional Name:4-(3-phenacyl-1H-pyrimidin-3-ium-6-ylidene)cyclohexa-2,5-dien-1-one bromide
Formula: C18H15BrN2O2
MolecularWeight: 371.2279
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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.[Br-]


Isomeric SMILES

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


InChI

InChI=1S/C18H14N2O2.BrH/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;1H


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