4-[[2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]benzoic acid Openeye Name: 4-[(2,4-dioxopyrimidin-1-yl)methyl]benzoic acid CAS Name: 4-[(2,4-dioxo-1-pyrimidinyl)methyl]benzoic acid IUPAC Name: 4-[(2,4-dioxopyrimidin-1-yl)methyl]benzoic acid Traditional Name: 4-[(2,4-diketopyrimidin-1-yl)methyl]benzoic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=CC(=O)NC2=O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CN2C=CC(=O)NC2=O)C(=O)O

InChI

InChI=1S/C12H10N2O4/c15-10-5-6-14(12(18)13-10)7-8-1-3-9(4-2-8)11(16)17/h1-6H,7H2,(H,16,17)(H,13,15,18)