5-methyl-2,4,6-trinitro-benzene-1,3-diamine

Systemtic Name: 5-methyl-2,4,6-trinitro-benzene-1,3-diamine Openeye Name: 5-methyl-2,4,6-trinitro-benzene-1,3-diamine CAS Name: 5-methyl-2,4,6-trinitrobenzene-1,3-diamine IUPAC Name: 5-methyl-2,4,6-trinitrobenzene-1,3-diamine Traditional Name: (3-amino-5-methyl-2,4,6-trinitro-phenyl)amine Formula: C7H7N5O6 MolecularWeight: 257.16038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7N5O6/c1-2-5(10(13)14)3(8)7(12(17)18)4(9)6(2)11(15)16/h8-9H2,1H3