benzene; N-methyl-N'-(4-methylphenyl)-N-(2,4,6-trinitrophenyl)naphthalene-1-carboximidamide

Systemtic Name: benzene; N-methyl-N'-(4-methylphenyl)-N-(2,4,6-trinitrophenyl)naphthalene-1-carboximidamide Openeye Name: benzene; N-methyl-N'-(p-tolyl)-N-(2,4,6-trinitrophenyl)naphthalene-1-carboxamidine CAS Name: benzene; N-methyl-N'-(4-methylphenyl)-N-(2,4,6-trinitrophenyl)-1-naphthalenecarboximidamide IUPAC Name: benzene; N-methyl-N'-(4-methylphenyl)-N-(2,4,6-trinitrophenyl)naphthalene-1-carboximidamide Traditional Name: benzene; N-methyl-N-picryl-N'-(p-tolyl)-1-naphthamidine Formula: C31H25N5O6 MolecularWeight: 563.5601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=C(C2=CC=CC3=CC=CC=C32)N(C)C4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C1=CC=CC=C1

Isomeric SMILES

CC1=CC=C(C=C1)N=C(C2=CC=CC3=CC=CC=C32)N(C)C4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C1=CC=CC=C1

InChI

InChI=1S/C25H19N5O6.C6H6/c1-16-10-12-18(13-11-16)26-25(21-9-5-7-17-6-3-4-8-20(17)21)27(2)24-22(29(33)34)14-19(28(31)32)15-23(24)30(35)36;1-2-4-6-5-3-1/h3-15H,1-2H3;1-6H