2-methylpropyl 4-[(4,6-dimethylpyrimidin-2-yl)amino]benzoate chloride

Systemtic Name: 2-methylpropyl 4-[(4,6-dimethylpyrimidin-2-yl)amino]benzoate chloride Openeye Name: isobutyl 4-[(4,6-dimethylpyrimidin-2-yl)amino]benzoate chloride CAS Name: 4-[(4,6-dimethyl-2-pyrimidinyl)amino]benzoic acid 2-methylpropyl ester chloride IUPAC Name: 2-methylpropyl 4-[(4,6-dimethylpyrimidin-2-yl)amino]benzoate chloride Traditional Name: 4-[(4,6-dimethylpyrimidin-2-yl)amino]benzoic acid isobutyl ester chloride Formula: C17H21ClN3O2- MolecularWeight: 334.82054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C(=O)OCC(C)C)C.[Cl-]

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C(=O)OCC(C)C)C.[Cl-]

InChI

InChI=1S/C17H21N3O2.ClH/c1-11(2)10-22-16(21)14-5-7-15(8-6-14)20-17-18-12(3)9-13(4)19-17;/h5-9,11H,10H2,1-4H3,(H,18,19,20);1H/p-1