3-naphthalen-1-yl-5-(4-nitrophenyl)-2-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 3-naphthalen-1-yl-5-(4-nitrophenyl)-2-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 2-benzyl-3-(1-naphthyl)-5-(4-nitrophenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 3-(1-naphthalenyl)-5-(4-nitrophenyl)-2-(phenylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 2-benzyl-3-naphthalen-1-yl-5-(4-nitrophenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 2-benzyl-3-(1-naphthyl)-5-(4-nitrophenyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C29H20N4O3 MolecularWeight: 472.4941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C3=NC(=CC(=O)N3N2)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C3=NC(=CC(=O)N3N2)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H20N4O3/c34-27-18-25(21-13-15-22(16-14-21)33(35)36)30-29-28(24-12-6-10-20-9-4-5-11-23(20)24)26(31-32(27)29)17-19-7-2-1-3-8-19/h1-16,18,31H,17H2