N-[5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-4-nitro-benzamide

Systemtic Name: N-[5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-4-nitro-benzamide Openeye Name: 4-nitro-N-[5-(p-tolyl)benzimidazolo[2,1-a]phthalazin-9-yl]benzamide CAS Name: N-[5-(4-methylphenyl)-9-benzimidazolo[2,1-a]phthalazinyl]-4-nitrobenzamide IUPAC Name: N-[5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-4-nitrobenzamide Traditional Name: 4-nitro-N-[5-(p-tolyl)benzimidazolo[2,1-a]phthalazin-9-yl]benzamide Formula: C28H19N5O3 MolecularWeight: 473.48216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN3C4=C(C=CC(=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-])N=C3C6=CC=CC=C62

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN3C4=C(C=CC(=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-])N=C3C6=CC=CC=C62

InChI

InChI=1S/C28H19N5O3/c1-17-6-8-18(9-7-17)26-22-4-2-3-5-23(22)27-30-24-15-12-20(16-25(24)32(27)31-26)29-28(34)19-10-13-21(14-11-19)33(35)36/h2-16H,1H3,(H,29,34)