N-(2,3-dinitrophenyl)-2,3,4,5,6-pentanitro-N-phenyl-aniline

Systemtic Name: N-(2,3-dinitrophenyl)-2,3,4,5,6-pentanitro-N-phenyl-aniline Openeye Name: N-(2,3-dinitrophenyl)-2,3,4,5,6-pentanitro-N-phenyl-aniline CAS Name: N-(2,3-dinitrophenyl)-2,3,4,5,6-pentanitro-N-phenylaniline IUPAC Name: N-(2,3-dinitrophenyl)-2,3,4,5,6-pentanitro-N-phenylaniline Traditional Name: (2,3-dinitrophenyl)-(2,3,4,5,6-pentanitrophenyl)-phenyl-amine Formula: C18H8N8O14 MolecularWeight: 560.30132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H8N8O14/c27-20(28)11-8-4-7-10(12(11)21(29)30)19(9-5-2-1-3-6-9)13-14(22(31)32)16(24(35)36)18(26(39)40)17(25(37)38)15(13)23(33)34/h1-8H