1-ethyl-3-methyl-6-(5-nitro-2-propoxy-phenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-ethyl-3-methyl-6-(5-nitro-2-propoxy-phenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-ethyl-3-methyl-6-(5-nitro-2-propoxy-phenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-ethyl-3-methyl-6-(5-nitro-2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-ethyl-3-methyl-6-(5-nitro-2-propoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-ethyl-3-methyl-6-(5-nitro-2-propoxy-phenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C17H19N5O4 MolecularWeight: 357.36386

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC(=O)C3=C(NN(C3=N2)CC)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC(=O)C3=C(NN(C3=N2)CC)C

InChI

InChI=1S/C17H19N5O4/c1-4-8-26-13-7-6-11(22(24)25)9-12(13)15-18-16-14(17(23)19-15)10(3)20-21(16)5-2/h6-7,9,20H,4-5,8H2,1-3H3