1,3-bis[(2-methoxy-5-nitro-phenyl)-phenyl-methyl]imidazol-1-ium

Systemtic Name: 1,3-bis[(2-methoxy-5-nitro-phenyl)-phenyl-methyl]imidazol-1-ium Openeye Name: 1,3-bis[(2-methoxy-5-nitro-phenyl)-phenyl-methyl]imidazol-1-ium CAS Name: 1,3-bis[(2-methoxy-5-nitrophenyl)-phenylmethyl]imidazol-1-ium IUPAC Name: 1,3-bis[(2-methoxy-5-nitrophenyl)-phenylmethyl]imidazol-1-ium Traditional Name: 1,3-bis[(2-methoxy-5-nitro-phenyl)-phenyl-methyl]imidazol-1-ium Formula: C31H27N4O6+ MolecularWeight: 551.56928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC=CC=C2)N3C=C[N+](=C3)C(C4=CC=CC=C4)C5=C(C=CC(=C5)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=CC=CC=C2)N3C=C[N+](=C3)C(C4=CC=CC=C4)C5=C(C=CC(=C5)[N+](=O)[O-])OC

InChI

InChI=1S/C31H27N4O6/c1-40-28-15-13-24(34(36)37)19-26(28)30(22-9-5-3-6-10-22)32-17-18-33(21-32)31(23-11-7-4-8-12-23)27-20-25(35(38)39)14-16-29(27)41-2/h3-21,30-31H,1-2H3/q+1