sodium 4-[(4-oxidanylidene-1H-quinazolin-2-yl)amino]benzenesulfonate

Systemtic Name: sodium 4-[(4-oxidanylidene-1H-quinazolin-2-yl)amino]benzenesulfonate Openeye Name: sodium 4-[(4-oxo-1H-quinazolin-2-yl)amino]benzenesulfonate CAS Name: sodium 4-[(4-oxo-1H-quinazolin-2-yl)amino]benzenesulfonate IUPAC Name: sodium 4-[(4-oxo-1H-quinazolin-2-yl)amino]benzenesulfonate Traditional Name: sodium 4-[(4-keto-1H-quinazolin-2-yl)amino]besylate Formula: C14H10N3NaO4S MolecularWeight: 339.30167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)NC3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)NC3=CC=C(C=C3)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H11N3O4S.Na/c18-13-11-3-1-2-4-12(11)16-14(17-13)15-9-5-7-10(8-6-9)22(19,20)21;/h1-8H,(H,19,20,21)(H2,15,16,17,18);/q;+1/p-1