4-[[2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]methyl]benzenesulfonic acid

Systemtic Name: 4-[[2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]methyl]benzenesulfonic acid Openeye Name: 4-[(2,4-dioxo-1H-pyrimidin-3-yl)methyl]benzenesulfonic acid CAS Name: 4-[(2,4-dioxo-1H-pyrimidin-3-yl)methyl]benzenesulfonic acid IUPAC Name: 4-[(2,4-dioxo-1H-pyrimidin-3-yl)methyl]benzenesulfonic acid Traditional Name: 4-[(2,4-diketo-1H-pyrimidin-3-yl)methyl]besylic acid Formula: C11H10N2O5S MolecularWeight: 282.2725

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=O)C=CNC2=O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1CN2C(=O)C=CNC2=O)S(=O)(=O)O

InChI

InChI=1S/C11H10N2O5S/c14-10-5-6-12-11(15)13(10)7-8-1-3-9(4-2-8)19(16,17)18/h1-6H,7H2,(H,12,15)(H,16,17,18)