N-(4-methylphenyl)-4-nitro-N'-phenyl-N-(2,4,6-trinitrophenyl)benzenecarboximidamide

Systemtic Name: N-(4-methylphenyl)-4-nitro-N'-phenyl-N-(2,4,6-trinitrophenyl)benzenecarboximidamide Openeye Name: 4-nitro-N'-phenyl-N-(p-tolyl)-N-(2,4,6-trinitrophenyl)benzamidine CAS Name: N-(4-methylphenyl)-4-nitro-N'-phenyl-N-(2,4,6-trinitrophenyl)benzenecarboximidamide IUPAC Name: N-(4-methylphenyl)-4-nitro-N'-phenyl-N-(2,4,6-trinitrophenyl)benzenecarboximidamide Traditional Name: 4-nitro-N'-phenyl-N-picryl-N-(p-tolyl)benzamidine Formula: C26H18N6O8 MolecularWeight: 542.45652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C(=NC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C(=NC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H18N6O8/c1-17-7-11-20(12-8-17)28(25-23(31(37)38)15-22(30(35)36)16-24(25)32(39)40)26(27-19-5-3-2-4-6-19)18-9-13-21(14-10-18)29(33)34/h2-16H,1H3