4-[(4-carboxylato-3-oxidanyl-phenyl)amino]quinazoline-7-carboxylate

Systemtic Name: 4-[(4-carboxylato-3-oxidanyl-phenyl)amino]quinazoline-7-carboxylate Openeye Name: 4-(4-carboxylato-3-hydroxy-anilino)quinazoline-7-carboxylate CAS Name: 4-(4-carboxylato-3-hydroxyanilino)-7-quinazolinecarboxylate IUPAC Name: 4-(4-carboxylato-3-hydroxyanilino)quinazoline-7-carboxylate Traditional Name: 4-(4-carboxylato-3-hydroxy-anilino)quinazoline-7-carboxylate Formula: C16H9N3O5-2 MolecularWeight: 323.25976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])N=CN=C2NC3=CC(=C(C=C3)C(=O)[O-])O

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])N=CN=C2NC3=CC(=C(C=C3)C(=O)[O-])O

InChI

InChI=1S/C16H11N3O5/c20-13-6-9(2-4-11(13)16(23)24)19-14-10-3-1-8(15(21)22)5-12(10)17-7-18-14/h1-7,20H,(H,21,22)(H,23,24)(H,17,18,19)/p-2