5-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[(2-methyl-6-phenylpyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]isophthalic acid Formula: C19H15N3O4 MolecularWeight: 349.3401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC(=CC(=C2)C(=O)O)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C19H15N3O4/c1-11-20-16(12-5-3-2-4-6-12)10-17(21-11)22-15-8-13(18(23)24)7-14(9-15)19(25)26/h2-10H,1H3,(H,23,24)(H,25,26)(H,20,21,22)