N-(3,5-dimethyl-2,4,6-trinitro-phenyl)-3,5-dimethyl-2,4,6-trinitro-aniline

Systemtic Name: N-(3,5-dimethyl-2,4,6-trinitro-phenyl)-3,5-dimethyl-2,4,6-trinitro-aniline Openeye Name: N-(3,5-dimethyl-2,4,6-trinitro-phenyl)-3,5-dimethyl-2,4,6-trinitro-aniline CAS Name: N-(3,5-dimethyl-2,4,6-trinitrophenyl)-3,5-dimethyl-2,4,6-trinitroaniline IUPAC Name: N-(3,5-dimethyl-2,4,6-trinitrophenyl)-3,5-dimethyl-2,4,6-trinitroaniline Traditional Name: bis(3,5-dimethyl-2,4,6-trinitro-phenyl)amine Formula: C16H13N7O12 MolecularWeight: 495.31412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N7O12/c1-5-11(18(24)25)6(2)14(21(30)31)9(13(5)20(28)29)17-10-15(22(32)33)7(3)12(19(26)27)8(4)16(10)23(34)35/h17H,1-4H3