5-(2-ethoxyphenyl)-1-[(2-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-(2-ethoxyphenyl)-1-[(2-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(2-ethoxyphenyl)-1-[(2-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(2-ethoxyphenyl)-1-[(2-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(2-ethoxyphenyl)-1-[(2-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-(2-nitrobenzyl)-5-o-phenetyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Formula: C23H23N5O4 MolecularWeight: 433.45982

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H23N5O4/c1-3-9-17-20-21(27(26-17)14-15-10-5-7-12-18(15)28(30)31)23(29)25-22(24-20)16-11-6-8-13-19(16)32-4-2/h5-8,10-13H,3-4,9,14H2,1-2H3,(H,24,25,29)