sodium 4-[[7-chloranyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]sulfonyl]-2-oxidanyl-benzoate

Systemtic Name: sodium 4-[[7-chloranyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]sulfonyl]-2-oxidanyl-benzoate Openeye Name: sodium 4-[(7-chloro-2,4-dioxo-1H-quinazolin-3-yl)sulfonyl]-2-hydroxy-benzoate CAS Name: sodium 4-[(7-chloro-2,4-dioxo-1H-quinazolin-3-yl)sulfonyl]-2-hydroxybenzoate IUPAC Name: sodium 4-[(7-chloro-2,4-dioxo-1H-quinazolin-3-yl)sulfonyl]-2-hydroxybenzoate Traditional Name: sodium 4-[(7-chloro-2,4-diketo-1H-quinazolin-3-yl)sulfonyl]-2-hydroxy-benzoate Formula: C15H8ClN2NaO7S MolecularWeight: 418.74099

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=O)O)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=O)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C15H9ClN2O7S.Na/c16-7-1-3-9-11(5-7)17-15(23)18(13(9)20)26(24,25)8-2-4-10(14(21)22)12(19)6-8;/h1-6,19H,(H,17,23)(H,21,22);/q;+1/p-1