2-[3-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]phenyl]ethanoic acid

Systemtic Name: 2-[3-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]phenyl]ethanoic acid Openeye Name: 2-[3-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]phenyl]acetic acid CAS Name: 2-[3-[3-[butyl-(5-ethyl-2-pyrimidinyl)amino]propoxy]phenyl]acetic acid IUPAC Name: 2-[3-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]phenyl]acetic acid Traditional Name: 2-[3-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]phenyl]acetic acid Formula: C21H29N3O3 MolecularWeight: 371.47326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCOC1=CC=CC(=C1)CC(=O)O)C2=NC=C(C=N2)CC

Isomeric SMILES

CCCCN(CCCOC1=CC=CC(=C1)CC(=O)O)C2=NC=C(C=N2)CC

InChI

InChI=1S/C21H29N3O3/c1-3-5-10-24(21-22-15-17(4-2)16-23-21)11-7-12-27-19-9-6-8-18(13-19)14-20(25)26/h6,8-9,13,15-16H,3-5,7,10-12,14H2,1-2H3,(H,25,26)