2-[[3-[[5-(4-methoxyphenoxy)pyrimidin-2-yl]amino]-3-phenyl-propyl]-methyl-amino]ethanoic acid

Systemtic Name: 2-[[3-[[5-(4-methoxyphenoxy)pyrimidin-2-yl]amino]-3-phenyl-propyl]-methyl-amino]ethanoic acid Openeye Name: 2-[[3-[[5-(4-methoxyphenoxy)pyrimidin-2-yl]amino]-3-phenyl-propyl]-methyl-amino]acetic acid CAS Name: 2-[[3-[[5-(4-methoxyphenoxy)-2-pyrimidinyl]amino]-3-phenylpropyl]-methylamino]acetic acid IUPAC Name: 2-[[3-[[5-(4-methoxyphenoxy)pyrimidin-2-yl]amino]-3-phenylpropyl]-methylamino]acetic acid Traditional Name: 2-[[3-[[5-(4-methoxyphenoxy)pyrimidin-2-yl]amino]-3-phenyl-propyl]-methyl-amino]acetic acid Formula: C23H26N4O4 MolecularWeight: 422.47694

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(C1=CC=CC=C1)NC2=NC=C(C=N2)OC3=CC=C(C=C3)OC)CC(=O)O

Isomeric SMILES

CN(CCC(C1=CC=CC=C1)NC2=NC=C(C=N2)OC3=CC=C(C=C3)OC)CC(=O)O

InChI

InChI=1S/C23H26N4O4/c1-27(16-22(28)29)13-12-21(17-6-4-3-5-7-17)26-23-24-14-20(15-25-23)31-19-10-8-18(30-2)9-11-19/h3-11,14-15,21H,12-13,16H2,1-2H3,(H,28,29)(H,24,25,26)