4-(5-octa-1,3,5,7-tetraynoxy-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(5-octa-1,3,5,7-tetraynoxy-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(5-octa-1,3,5,7-tetraynoxy-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(5-octa-1,3,5,7-tetraynoxy-1H-pyrimidin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(5-octa-1,3,5,7-tetraynoxy-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(5-octa-1,3,5,7-tetraynoxy-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C18H8N2O2 MolecularWeight: 284.26832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC#CC#CC#COC1=CNC(=C2C=CC(=O)C=C2)N=C1

Isomeric SMILES

C#CC#CC#CC#COC1=CNC(=C2C=CC(=O)C=C2)N=C1

InChI

InChI=1S/C18H8N2O2/c1-2-3-4-5-6-7-12-22-17-13-19-18(20-14-17)15-8-10-16(21)11-9-15/h1,8-11,13-14,19H