5-[(6-oxidanylidene-4-phenyl-pyrimidin-1-yl)methyl]furan-2-carboxylic acid

Systemtic Name: 5-[(6-oxidanylidene-4-phenyl-pyrimidin-1-yl)methyl]furan-2-carboxylic acid Openeye Name: 5-[(6-oxo-4-phenyl-pyrimidin-1-yl)methyl]furan-2-carboxylic acid CAS Name: 5-[(6-oxo-4-phenyl-1-pyrimidinyl)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(6-oxo-4-phenylpyrimidin-1-yl)methyl]furan-2-carboxylic acid Traditional Name: 5-[(6-keto-4-phenyl-pyrimidin-1-yl)methyl]-2-furoic acid Formula: C16H12N2O4 MolecularWeight: 296.27748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC3=CC=C(O3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC3=CC=C(O3)C(=O)O

InChI

InChI=1S/C16H12N2O4/c19-15-8-13(11-4-2-1-3-5-11)17-10-18(15)9-12-6-7-14(22-12)16(20)21/h1-8,10H,9H2,(H,20,21)