4-methyl-2,3,6-trinitro-aniline

Systemtic Name: 4-methyl-2,3,6-trinitro-aniline Openeye Name: 4-methyl-2,3,6-trinitro-aniline CAS Name: 4-methyl-2,3,6-trinitroaniline IUPAC Name: 4-methyl-2,3,6-trinitroaniline Traditional Name: (4-methyl-2,3,6-trinitro-phenyl)amine Formula: C7H6N4O6 MolecularWeight: 242.14574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6N4O6/c1-3-2-4(9(12)13)5(8)7(11(16)17)6(3)10(14)15/h2H,8H2,1H3