3-[(4-phenylpyrimidin-2-yl)amino]benzoic acid

Systemtic Name: 3-[(4-phenylpyrimidin-2-yl)amino]benzoic acid Openeye Name: 3-[(4-phenylpyrimidin-2-yl)amino]benzoic acid CAS Name: 3-[(4-phenyl-2-pyrimidinyl)amino]benzoic acid IUPAC Name: 3-[(4-phenylpyrimidin-2-yl)amino]benzoic acid Traditional Name: 3-[(4-phenylpyrimidin-2-yl)amino]benzoic acid Formula: C17H13N3O2 MolecularWeight: 291.30402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H13N3O2/c21-16(22)13-7-4-8-14(11-13)19-17-18-10-9-15(20-17)12-5-2-1-3-6-12/h1-11H,(H,21,22)(H,18,19,20)