2-(4-methylphenyl)-4,6-dinitro-benzene-1,3,5-triamine

Systemtic Name: 2-(4-methylphenyl)-4,6-dinitro-benzene-1,3,5-triamine Openeye Name: 2,4-dinitro-6-(p-tolyl)benzene-1,3,5-triamine CAS Name: 2-(4-methylphenyl)-4,6-dinitrobenzene-1,3,5-triamine IUPAC Name: 2-(4-methylphenyl)-4,6-dinitrobenzene-1,3,5-triamine Traditional Name: [3,5-diamino-2,4-dinitro-6-(p-tolyl)phenyl]amine Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C(C(=C2N)[N+](=O)[O-])N)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C(C(=C2N)[N+](=O)[O-])N)[N+](=O)[O-])N

InChI

InChI=1S/C13H13N5O4/c1-6-2-4-7(5-3-6)8-9(14)12(17(19)20)11(16)13(10(8)15)18(21)22/h2-5H,14-16H2,1H3