1,3-dinitro-2,4-bis(2,4,6-trinitrophenoxy)benzene

Systemtic Name: 1,3-dinitro-2,4-bis(2,4,6-trinitrophenoxy)benzene Openeye Name: 1,3-dinitro-2,4-bis(2,4,6-trinitrophenoxy)benzene CAS Name: 1,3-dinitro-2,4-bis(2,4,6-trinitrophenoxy)benzene IUPAC Name: 1,3-dinitro-2,4-bis(2,4,6-trinitrophenoxy)benzene Traditional Name: 1,3-dinitro-2,4-bis(2,4,6-trinitrophenoxy)benzene Formula: C18H6N8O18 MolecularWeight: 622.28304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1[N+](=O)[O-])OC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])OC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1[N+](=O)[O-])OC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])OC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H6N8O18/c27-19(28)7-3-10(22(33)34)16(11(4-7)23(35)36)43-14-2-1-9(21(31)32)18(15(14)26(41)42)44-17-12(24(37)38)5-8(20(29)30)6-13(17)25(39)40/h1-6H