3-[4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)phenyl]propanoic acid CAS Name: 3-[4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)phenyl]propanoic acid IUPAC Name: 3-[4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-ethoxy-3-(1-methyl-3-propyl-4,7-dihydropyrazolo[4,3-d]pyrimidin-5-yl)phenyl]propionic acid Formula: C20H26N4O3 MolecularWeight: 370.44544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2)C3=C(C=CC(=C3)CCC(=O)O)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2)C3=C(C=CC(=C3)CCC(=O)O)OCC)C

InChI

InChI=1S/C20H26N4O3/c1-4-6-15-19-16(24(3)23-15)12-21-20(22-19)14-11-13(8-10-18(25)26)7-9-17(14)27-5-2/h7,9,11H,4-6,8,10,12H2,1-3H3,(H,21,22)(H,25,26)