1,3,5-trinitro-2,4-bis(2,4,6-trinitrophenyl)benzene

Systemtic Name: 1,3,5-trinitro-2,4-bis(2,4,6-trinitrophenyl)benzene Openeye Name: 1,3,5-trinitro-2,4-bis(2,4,6-trinitrophenyl)benzene CAS Name: 1,3,5-trinitro-2,4-bis(2,4,6-trinitrophenyl)benzene IUPAC Name: 1,3,5-trinitro-2,4-bis(2,4,6-trinitrophenyl)benzene Traditional Name: 1,3,5-trinitro-2,4-dipicryl-benzene Formula: C18H5N9O18 MolecularWeight: 635.2818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H5N9O18/c28-19(29)6-1-8(21(32)33)14(9(2-6)22(34)35)16-12(25(40)41)5-13(26(42)43)17(18(16)27(44)45)15-10(23(36)37)3-7(20(30)31)4-11(15)24(38)39/h1-5H