[3-[(6-methylpyrimidin-4-yl)amino]phenyl] 2-(2,3,5-trimethylphenoxy)ethanoate

Systemtic Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] 2-(2,3,5-trimethylphenoxy)ethanoate Openeye Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] 2-(2,3,5-trimethylphenoxy)acetate CAS Name: 2-(2,3,5-trimethylphenoxy)acetic acid [3-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(6-methylpyrimidin-4-yl)amino]phenyl] 2-(2,3,5-trimethylphenoxy)acetate Traditional Name: 2-(2,3,5-trimethylphenoxy)acetic acid [3-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC(=O)OC2=CC=CC(=C2)NC3=NC=NC(=C3)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC(=O)OC2=CC=CC(=C2)NC3=NC=NC(=C3)C)C)C

InChI

InChI=1S/C22H23N3O3/c1-14-8-15(2)17(4)20(9-14)27-12-22(26)28-19-7-5-6-18(11-19)25-21-10-16(3)23-13-24-21/h5-11,13H,12H2,1-4H3,(H,23,24,25)