2-[5-(5-ethanoyl-2-propoxy-pyridin-3-yl)-3-ethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-1-yl]ethanoic acid

Systemtic Name: 2-[5-(5-ethanoyl-2-propoxy-pyridin-3-yl)-3-ethyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-1-yl]ethanoic acid Openeye Name: 2-[5-(5-acetyl-2-propoxy-3-pyridyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-1-yl]acetic acid CAS Name: 2-[5-(5-acetyl-2-propoxy-3-pyridinyl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-1-yl]acetic acid IUPAC Name: 2-[5-(5-acetyl-2-propoxypyridin-3-yl)-3-ethyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-1-yl]acetic acid Traditional Name: 2-[5-(5-acetyl-2-propoxy-3-pyridyl)-3-ethyl-7-keto-4H-pyrazolo[4,3-d]pyrimidin-1-yl]acetic acid Formula: C19H21N5O5 MolecularWeight: 399.40054

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC=C(C=C1C2=NC(=O)C3=C(N2)C(=NN3CC(=O)O)CC)C(=O)C

Isomeric SMILES

CCCOC1=NC=C(C=C1C2=NC(=O)C3=C(N2)C(=NN3CC(=O)O)CC)C(=O)C

InChI

InChI=1S/C19H21N5O5/c1-4-6-29-19-12(7-11(8-20-19)10(3)25)17-21-15-13(5-2)23-24(9-14(26)27)16(15)18(28)22-17/h7-8H,4-6,9H2,1-3H3,(H,26,27)(H,21,22,28)