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

Systemtic Name: N,N'-bis(4-methylphenyl)-N-(2,4,6-trinitrophenyl)benzenecarboximidamide Openeye Name: N,N'-bis(p-tolyl)-N-(2,4,6-trinitrophenyl)benzamidine CAS Name: N,N'-bis(4-methylphenyl)-N-(2,4,6-trinitrophenyl)benzenecarboximidamide IUPAC Name: N,N'-bis(4-methylphenyl)-N-(2,4,6-trinitrophenyl)benzenecarboximidamide Traditional Name: N-picryl-N,N'-bis(p-tolyl)benzamidine Formula: C27H21N5O6 MolecularWeight: 511.48554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H21N5O6/c1-18-8-12-21(13-9-18)28-27(20-6-4-3-5-7-20)29(22-14-10-19(2)11-15-22)26-24(31(35)36)16-23(30(33)34)17-25(26)32(37)38/h3-17H,1-2H3