4-methyl-N,N-bis(4-methyl-2-nitro-phenyl)-2-nitro-aniline

Systemtic Name: 4-methyl-N,N-bis(4-methyl-2-nitro-phenyl)-2-nitro-aniline Openeye Name: 4-methyl-N,N-bis(4-methyl-2-nitro-phenyl)-2-nitro-aniline CAS Name: 4-methyl-N,N-bis(4-methyl-2-nitrophenyl)-2-nitroaniline IUPAC Name: 4-methyl-N,N-bis(4-methyl-2-nitrophenyl)-2-nitroaniline Traditional Name: tris(4-methyl-2-nitro-phenyl)amine Formula: C21H18N4O6 MolecularWeight: 422.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C2=C(C=C(C=C2)C)[N+](=O)[O-])C3=C(C=C(C=C3)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N(C2=C(C=C(C=C2)C)[N+](=O)[O-])C3=C(C=C(C=C3)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O6/c1-13-4-7-16(19(10-13)23(26)27)22(17-8-5-14(2)11-20(17)24(28)29)18-9-6-15(3)12-21(18)25(30)31/h4-12H,1-3H3