2-[3-[[(4-pyrimidin-5-ylphenyl)methylamino]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[[(4-pyrimidin-5-ylphenyl)methylamino]methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[[(4-pyrimidin-5-ylphenyl)methylamino]methyl]phenoxy]acetic acid CAS Name: 2-[3-[[[4-(5-pyrimidinyl)phenyl]methylamino]methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[[(4-pyrimidin-5-ylphenyl)methylamino]methyl]phenoxy]acetic acid Traditional Name: 2-[3-[[[4-(5-pyrimidyl)benzyl]amino]methyl]phenoxy]acetic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(=O)O)CNCC2=CC=C(C=C2)C3=CN=CN=C3

Isomeric SMILES

C1=CC(=CC(=C1)OCC(=O)O)CNCC2=CC=C(C=C2)C3=CN=CN=C3

InChI

InChI=1S/C20H19N3O3/c24-20(25)13-26-19-3-1-2-16(8-19)10-21-9-15-4-6-17(7-5-15)18-11-22-14-23-12-18/h1-8,11-12,14,21H,9-10,13H2,(H,24,25)