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

Systemtic Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-(3-methylphenoxy)ethanoate Openeye Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-(3-methylphenoxy)acetate CAS Name: 2-(3-methylphenoxy)acetic acid [4-[(4,6-dimethyl-2-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-(3-methylphenoxy)acetate Traditional Name: 2-(3-methylphenoxy)acetic acid [4-[(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(=CC=C1)OCC(=O)OC2=CC=C(C=C2)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

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

InChI

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