[2,4-bis(oxidanylidene)-1H-pteridin-3-yl] benzenesulfonate

Systemtic Name: [2,4-bis(oxidanylidene)-1H-pteridin-3-yl] benzenesulfonate Openeye Name: (2,4-dioxo-1H-pteridin-3-yl) benzenesulfonate CAS Name: benzenesulfonic acid (2,4-dioxo-1H-pteridin-3-yl) ester IUPAC Name: (2,4-dioxo-1H-pteridin-3-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (2,4-diketo-1H-pteridin-3-yl) ester Formula: C12H8N4O5S MolecularWeight: 320.28072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=NC=CN=C3NC2=O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=NC=CN=C3NC2=O

InChI

InChI=1S/C12H8N4O5S/c17-11-9-10(14-7-6-13-9)15-12(18)16(11)21-22(19,20)8-4-2-1-3-5-8/h1-7H,(H,14,15,18)