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

Systemtic Name: 5-(2-ethoxyphenyl)-1-[(4-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 5-(2-ethoxyphenyl)-1-[(4-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(2-ethoxyphenyl)-1-[(4-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 5-(2-ethoxyphenyl)-1-[(4-nitrophenyl)methyl]-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 1-(4-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=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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