sodium 1-(3-chloranyl-5-sulfo-phenyl)-4,6-bis(oxidanylidene)pyrimidin-2-olate

Systemtic Name: sodium 1-(3-chloranyl-5-sulfo-phenyl)-4,6-bis(oxidanylidene)pyrimidin-2-olate Openeye Name: sodium 1-(3-chloro-5-sulfo-phenyl)-4,6-dioxo-pyrimidin-2-olate CAS Name: sodium 1-(3-chloro-5-sulfophenyl)-4,6-dioxo-2-pyrimidinolate IUPAC Name: sodium 1-(3-chloro-5-sulfophenyl)-4,6-dioxopyrimidin-2-olate Traditional Name: sodium 1-(3-chloro-5-sulfo-phenyl)-4,6-diketo-pyrimidin-2-olate Formula: C10H6ClN2NaO6S MolecularWeight: 340.67221

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N=C(N(C1=O)C2=CC(=CC(=C2)Cl)S(=O)(=O)O)[O-].[Na+]

Isomeric SMILES

C1C(=O)N=C(N(C1=O)C2=CC(=CC(=C2)Cl)S(=O)(=O)O)[O-].[Na+]

InChI

InChI=1S/C10H7ClN2O6S.Na/c11-5-1-6(3-7(2-5)20(17,18)19)13-9(15)4-8(14)12-10(13)16;/h1-3H,4H2,(H,12,14,16)(H,17,18,19);/q;+1/p-1