1,5-dinitro-2,4-bis[(E)-2-(3-phenylmethoxyphenyl)ethenyl]benzene

Systemtic Name: 1,5-dinitro-2,4-bis[(E)-2-(3-phenylmethoxyphenyl)ethenyl]benzene Openeye Name: 1,5-bis[(E)-2-(3-benzyloxyphenyl)vinyl]-2,4-dinitro-benzene CAS Name: 1,5-dinitro-2,4-bis[(E)-2-(3-phenylmethoxyphenyl)ethenyl]benzene IUPAC Name: 1,5-dinitro-2,4-bis[(E)-2-(3-phenylmethoxyphenyl)ethenyl]benzene Traditional Name: 1,5-bis[(E)-2-(3-benzoxyphenyl)vinyl]-2,4-dinitro-benzene Formula: C36H28N2O6 MolecularWeight: 584.61732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C=CC3=CC(=C(C=C3[N+](=O)[O-])[N+](=O)[O-])C=CC4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)/C=C/C3=CC(=C(C=C3[N+](=O)[O-])[N+](=O)[O-])/C=C/C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C36H28N2O6/c39-37(40)35-24-36(38(41)42)32(20-18-28-14-8-16-34(22-28)44-26-30-11-5-2-6-12-30)23-31(35)19-17-27-13-7-15-33(21-27)43-25-29-9-3-1-4-10-29/h1-24H,25-26H2/b19-17+,20-18+