N-(2,3-dimethylphenyl)-2,4,6-trinitro-aniline

Systemtic Name: N-(2,3-dimethylphenyl)-2,4,6-trinitro-aniline Openeye Name: N-(2,3-dimethylphenyl)-2,4,6-trinitro-aniline CAS Name: N-(2,3-dimethylphenyl)-2,4,6-trinitroaniline IUPAC Name: N-(2,3-dimethylphenyl)-2,4,6-trinitroaniline Traditional Name: (2,3-dimethylphenyl)-picryl-amine Formula: C14H12N4O6 MolecularWeight: 332.26828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C14H12N4O6/c1-8-4-3-5-11(9(8)2)15-14-12(17(21)22)6-10(16(19)20)7-13(14)18(23)24/h3-7,15H,1-2H3