1-methyl-5-(4-nitrophenyl)-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 1-methyl-5-(4-nitrophenyl)-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 1-methyl-5-(4-nitrophenyl)-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1-methyl-5-(4-nitrophenyl)-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 1-methyl-5-(4-nitrophenyl)-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-methyl-5-(4-nitrophenyl)-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C15H15N5O3 MolecularWeight: 313.3113

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C15H15N5O3/c1-3-4-11-12-13(19(2)18-11)15(21)17-14(16-12)9-5-7-10(8-6-9)20(22)23/h5-8H,3-4H2,1-2H3,(H,16,17,21)