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

Systemtic Name: 4-[(4-methyl-6-propan-2-yloxy-pyrimidin-2-yl)amino]benzoic acid hydrochloride Openeye Name: 4-[(4-isopropoxy-6-methyl-pyrimidin-2-yl)amino]benzoic acid hydrochloride CAS Name: 4-[(4-methyl-6-propan-2-yloxy-2-pyrimidinyl)amino]benzoic acid hydrochloride IUPAC Name: 4-[(4-methyl-6-propan-2-yloxypyrimidin-2-yl)amino]benzoic acid hydrochloride Traditional Name: 4-[(4-isopropoxy-6-methyl-pyrimidin-2-yl)amino]benzoic acid hydrochloride Formula: C15H18ClN3O3 MolecularWeight: 323.77472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C(=O)O)OC(C)C.Cl

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C(=O)O)OC(C)C.Cl

InChI

InChI=1S/C15H17N3O3.ClH/c1-9(2)21-13-8-10(3)16-15(18-13)17-12-6-4-11(5-7-12)14(19)20;/h4-9H,1-3H3,(H,19,20)(H,16,17,18);1H