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

Systemtic Name: 3-naphthalen-1-yl-5-(4-nitrophenyl)-2-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-olate Openeye Name: 2-benzyl-3-(1-naphthyl)-5-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidin-7-olate CAS Name: 3-(1-naphthalenyl)-5-(4-nitrophenyl)-2-(phenylmethyl)-7-pyrazolo[1,5-a]pyrimidinolate IUPAC Name: 2-benzyl-3-naphthalen-1-yl-5-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidin-7-olate Traditional Name: 2-benzyl-3-(1-naphthyl)-5-(4-nitrophenyl)pyrazolo[1,5-a]pyrimidin-7-olate Formula: C29H19N4O3- MolecularWeight: 471.48616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN3C(=CC(=NC3=C2C4=CC=CC5=CC=CC=C54)C6=CC=C(C=C6)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN3C(=CC(=NC3=C2C4=CC=CC5=CC=CC=C54)C6=CC=C(C=C6)[N+](=O)[O-])[O-]

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/h1-16,18,34H,17H2/p-1