2,4,6-tris[4-[(E)-2-nitroethenyl]phenoxy]-1,3,5-triazine

Systemtic Name: 2,4,6-tris[4-[(E)-2-nitroethenyl]phenoxy]-1,3,5-triazine Openeye Name: 2,4,6-tris[4-[(E)-2-nitrovinyl]phenoxy]-1,3,5-triazine CAS Name: 2,4,6-tris[4-[(E)-2-nitroethenyl]phenoxy]-1,3,5-triazine IUPAC Name: 2,4,6-tris[4-[(E)-2-nitroethenyl]phenoxy]-1,3,5-triazine Traditional Name: 2,4,6-tris[4-[(E)-2-nitrovinyl]phenoxy]-s-triazine Formula: C27H18N6O9 MolecularWeight: 570.46662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C[N+](=O)[O-])OC2=NC(=NC(=N2)OC3=CC=C(C=C3)C=C[N+](=O)[O-])OC4=CC=C(C=C4)C=C[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/[N+](=O)[O-])OC2=NC(=NC(=N2)OC3=CC=C(C=C3)/C=C/[N+](=O)[O-])OC4=CC=C(C=C4)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C27H18N6O9/c34-31(35)16-13-19-1-7-22(8-2-19)40-25-28-26(41-23-9-3-20(4-10-23)14-17-32(36)37)30-27(29-25)42-24-11-5-21(6-12-24)15-18-33(38)39/h1-18H/b16-13+,17-14+,18-15+