4,6-dimethyl-N-phenyl-pyrimidin-2-amine; 2-phenoxyethanoic acid

Systemtic Name: 4,6-dimethyl-N-phenyl-pyrimidin-2-amine; 2-phenoxyethanoic acid Openeye Name: 4,6-dimethyl-N-phenyl-pyrimidin-2-amine; 2-phenoxyacetic acid CAS Name: 4,6-dimethyl-N-phenyl-2-pyrimidinamine; 2-phenoxyacetic acid IUPAC Name: 4,6-dimethyl-N-phenylpyrimidin-2-amine; 2-phenoxyacetic acid Traditional Name: (4,6-dimethylpyrimidin-2-yl)-phenyl-amine; 2-phenoxyacetic acid Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=CC=C2)C.C1=CC=C(C=C1)OCC(=O)O

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=CC=C2)C.C1=CC=C(C=C1)OCC(=O)O

InChI

InChI=1S/C12H13N3.C8H8O3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11;9-8(10)6-11-7-4-2-1-3-5-7/h3-8H,1-2H3,(H,13,14,15);1-5H,6H2,(H,9,10)