2-[[2-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-1H-indol-5-yl]oxy]ethanoic acid

Systemtic Name: 2-[[2-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-1H-indol-5-yl]oxy]ethanoic acid Openeye Name: 2-[[2-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-1H-indol-5-yl]oxy]acetic acid CAS Name: 2-[[2-[4-(3,4-dimethoxyphenyl)-2-pyrimidinyl]-1H-indol-5-yl]oxy]acetic acid IUPAC Name: 2-[[2-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-1H-indol-5-yl]oxy]acetic acid Traditional Name: 2-[[2-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-1H-indol-5-yl]oxy]acetic acid Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2)C3=CC4=C(N3)C=CC(=C4)OCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2)C3=CC4=C(N3)C=CC(=C4)OCC(=O)O)OC

InChI

InChI=1S/C22H19N3O5/c1-28-19-6-3-13(11-20(19)29-2)17-7-8-23-22(25-17)18-10-14-9-15(30-12-21(26)27)4-5-16(14)24-18/h3-11,24H,12H2,1-2H3,(H,26,27)