4-methyl-N-[(E)-(2,4,6-trinitrophenyl)methylideneamino]aniline

Systemtic Name: 4-methyl-N-[(E)-(2,4,6-trinitrophenyl)methylideneamino]aniline Openeye Name: 4-methyl-N-[(E)-(2,4,6-trinitrophenyl)methyleneamino]aniline CAS Name: 4-methyl-N-[(E)-(2,4,6-trinitrophenyl)methylideneamino]aniline IUPAC Name: 4-methyl-N-[(E)-(2,4,6-trinitrophenyl)methylideneamino]aniline Traditional Name: p-tolyl-[(E)-(2,4,6-trinitrobenzylidene)amino]amine Formula: C14H11N5O6 MolecularWeight: 345.26704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN=CC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H11N5O6/c1-9-2-4-10(5-3-9)16-15-8-12-13(18(22)23)6-11(17(20)21)7-14(12)19(24)25/h2-8,16H,1H3/b15-8+