5,7-diphenylpyrano[2,3-d]pyrimidin-1-ium-2,4-dione perchlorate

Systemtic Name: 5,7-diphenylpyrano[2,3-d]pyrimidin-1-ium-2,4-dione perchlorate Openeye Name: 5,7-diphenylpyrano[2,3-d]pyrimidin-1-ium-2,4-dione perchlorate CAS Name: 5,7-diphenylpyrano[2,3-d]pyrimidin-1-ium-2,4-dione perchlorate IUPAC Name: 5,7-diphenylpyrano[2,3-d]pyrimidin-1-ium-2,4-dione perchlorate Traditional Name: 5,7-diphenylpyrano[2,3-d]pyrimidin-1-ium-2,4-quinone perchlorate Formula: C19H13ClN2O7 MolecularWeight: 416.76872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C3C(=O)NC(=O)[NH+]=C3O2)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C3C(=O)NC(=O)[NH+]=C3O2)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H12N2O3.ClHO4/c22-17-16-14(12-7-3-1-4-8-12)11-15(13-9-5-2-6-10-13)24-18(16)21-19(23)20-17;2-1(3,4)5/h1-11H,(H,20,22,23);(H,2,3,4,5)