1-methyl-5-[2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-methyl-5-[2-oxidanyl-3-(2-prop-2-enylphenoxy)propyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[3-(2-allylphenoxy)-2-hydroxy-propyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-hydroxy-3-(2-prop-2-enylphenoxy)propyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[3-(2-allylphenoxy)-2-hydroxy-propyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(COC3=CC=CC=C3CC=C)O

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(COC3=CC=CC=C3CC=C)O

InChI

InChI=1S/C18H20N4O3/c1-3-6-13-7-4-5-8-16(13)25-11-14(23)10-22-12-19-17-15(18(22)24)9-20-21(17)2/h3-5,7-9,12,14,23H,1,6,10-11H2,2H3