2-[4-[(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)methyl]phenoxy]acetic acid CAS Name: 2-[4-[(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)methyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)methyl]phenoxy]acetic acid Traditional Name: 2-[4-[(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)methyl]phenoxy]acetic acid Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)CC3=CC=C(C=C3)OCC(=O)O)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)CC3=CC=C(C=C3)OCC(=O)O)C

InChI

InChI=1S/C18H20N4O4/c1-3-4-13-16-17(22(2)21-13)18(25)20-14(19-16)9-11-5-7-12(8-6-11)26-10-15(23)24/h5-8H,3-4,9-10H2,1-2H3,(H,23,24)(H,19,20,25)