3-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)amino]benzoic acid

Systemtic Name: 3-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)amino]benzoic acid Openeye Name: 3-[(2-isopropyl-6-methyl-pyrimidin-4-yl)amino]benzoic acid CAS Name: 3-[(6-methyl-2-propan-2-yl-4-pyrimidinyl)amino]benzoic acid IUPAC Name: 3-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)amino]benzoic acid Traditional Name: 3-[(2-isopropyl-6-methyl-pyrimidin-4-yl)amino]benzoic acid Formula: C15H17N3O2 MolecularWeight: 271.31438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O2/c1-9(2)14-16-10(3)7-13(18-14)17-12-6-4-5-11(8-12)15(19)20/h4-9H,1-3H3,(H,19,20)(H,16,17,18)