[2,4-bis(oxidanylidene)-1H-pyrido[3,4-d]pyrimidin-3-yl] benzenesulfonate

Systemtic Name: [2,4-bis(oxidanylidene)-1H-pyrido[3,4-d]pyrimidin-3-yl] benzenesulfonate Openeye Name: (2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl) benzenesulfonate CAS Name: benzenesulfonic acid (2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl) ester IUPAC Name: (2,4-dioxo-1H-pyrido[3,4-d]pyrimidin-3-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (2,4-diketo-1H-pyrido[3,4-d]pyrimidin-3-yl) ester Formula: C13H9N3O5S MolecularWeight: 319.29266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=C(C=NC=C3)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)ON2C(=O)C3=C(C=NC=C3)NC2=O

InChI

InChI=1S/C13H9N3O5S/c17-12-10-6-7-14-8-11(10)15-13(18)16(12)21-22(19,20)9-4-2-1-3-5-9/h1-8H,(H,15,18)