1-nitro-4-[3-(4-nitrophenoxy)-2,2-bis[(4-nitrophenoxy)methyl]propoxy]benzene

Systemtic Name: 1-nitro-4-[3-(4-nitrophenoxy)-2,2-bis[(4-nitrophenoxy)methyl]propoxy]benzene Openeye Name: 1-nitro-4-[3-(4-nitrophenoxy)-2,2-bis[(4-nitrophenoxy)methyl]propoxy]benzene CAS Name: 1-nitro-4-[3-(4-nitrophenoxy)-2,2-bis[(4-nitrophenoxy)methyl]propoxy]benzene IUPAC Name: 1-nitro-4-[3-(4-nitrophenoxy)-2,2-bis[(4-nitrophenoxy)methyl]propoxy]benzene Traditional Name: 1-nitro-4-[3-(4-nitrophenoxy)-2,2-bis[(4-nitrophenoxy)methyl]propoxy]benzene Formula: C29H24N4O12 MolecularWeight: 620.52046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCC(COC2=CC=C(C=C2)[N+](=O)[O-])(COC3=CC=C(C=C3)[N+](=O)[O-])COC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(COC2=CC=C(C=C2)[N+](=O)[O-])(COC3=CC=C(C=C3)[N+](=O)[O-])COC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H24N4O12/c34-30(35)21-1-9-25(10-2-21)42-17-29(18-43-26-11-3-22(4-12-26)31(36)37,19-44-27-13-5-23(6-14-27)32(38)39)20-45-28-15-7-24(8-16-28)33(40)41/h1-16H,17-20H2