N1-methyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine

Systemtic Name: N1-methyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine Openeye Name: N1-methyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine CAS Name: N1-methyl-N2-(2,4,6-trinitrophenyl)benzene-1,2-diamine IUPAC Name: 1-N-methyl-2-N-(2,4,6-trinitrophenyl)benzene-1,2-diamine Traditional Name: methyl-[2-(2,4,6-trinitroanilino)phenyl]amine Formula: C13H11N5O6 MolecularWeight: 333.25634

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=CC=C1NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CNC1=CC=CC=C1NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H11N5O6/c1-14-9-4-2-3-5-10(9)15-13-11(17(21)22)6-8(16(19)20)7-12(13)18(23)24/h2-7,14-15H,1H3