2,6-bis[(2-carboxyphenyl)amino]pyrimidine-4-carboxylic acid hydrochloride

Systemtic Name: 2,6-bis[(2-carboxyphenyl)amino]pyrimidine-4-carboxylic acid hydrochloride Openeye Name: 2,6-bis(2-carboxyanilino)pyrimidine-4-carboxylic acid hydrochloride CAS Name: 2,6-bis(2-carboxyanilino)-4-pyrimidinecarboxylic acid hydrochloride IUPAC Name: 2,6-bis(2-carboxyanilino)pyrimidine-4-carboxylic acid hydrochloride Traditional Name: 2,6-bis(2-carboxyanilino)pyrimidine-4-carboxylic acid hydrochloride Formula: C19H15ClN4O6 MolecularWeight: 430.7986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=NC(=NC(=C2)C(=O)O)NC3=CC=CC=C3C(=O)O.Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=NC(=NC(=C2)C(=O)O)NC3=CC=CC=C3C(=O)O.Cl

InChI

InChI=1S/C19H14N4O6.ClH/c24-16(25)10-5-1-3-7-12(10)20-15-9-14(18(28)29)22-19(23-15)21-13-8-4-2-6-11(13)17(26)27;/h1-9H,(H,24,25)(H,26,27)(H,28,29)(H2,20,21,22,23);1H