[3-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-(4-methylphenoxy)ethanoate

Systemtic Name: [3-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-(4-methylphenoxy)ethanoate Openeye Name: [3-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-(4-methylphenoxy)acetate CAS Name: 2-(4-methylphenoxy)acetic acid [3-[(4,6-dimethyl-2-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-(4-methylphenoxy)acetate Traditional Name: 2-(4-methylphenoxy)acetic acid [3-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] ester Formula: C21H21N3O3 MolecularWeight: 363.40974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)OC2=CC=CC(=C2)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)OC2=CC=CC(=C2)NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C21H21N3O3/c1-14-7-9-18(10-8-14)26-13-20(25)27-19-6-4-5-17(12-19)24-21-22-15(2)11-16(3)23-21/h4-12H,13H2,1-3H3,(H,22,23,24)