N-(2,4-dinitrophenyl)-5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-amine

Systemtic Name: N-(2,4-dinitrophenyl)-5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-amine Openeye Name: N-(2,4-dinitrophenyl)-5-(p-tolyl)benzimidazolo[2,1-a]phthalazin-9-amine CAS Name: N-(2,4-dinitrophenyl)-5-(4-methylphenyl)-9-benzimidazolo[2,1-a]phthalazinamine IUPAC Name: N-(2,4-dinitrophenyl)-5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-amine Traditional Name: (2,4-dinitrophenyl)-[5-(p-tolyl)benzimidazolo[2,1-a]phthalazin-9-yl]amine Formula: C27H18N6O4 MolecularWeight: 490.46962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN3C4=C(C=CC(=C4)NC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-])N=C3C6=CC=CC=C62

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN3C4=C(C=CC(=C4)NC5=C(C=C(C=C5)[N+](=O)[O-])[N+](=O)[O-])N=C3C6=CC=CC=C62

InChI

InChI=1S/C27H18N6O4/c1-16-6-8-17(9-7-16)26-20-4-2-3-5-21(20)27-29-22-12-10-18(14-24(22)31(27)30-26)28-23-13-11-19(32(34)35)15-25(23)33(36)37/h2-15,28H,1H3