bis(4-hexadecoxyphenyl)-bis[(2-nitrophenyl)methoxy]silane

Systemtic Name: bis(4-hexadecoxyphenyl)-bis[(2-nitrophenyl)methoxy]silane Openeye Name: bis(4-hexadecoxyphenyl)-bis[(2-nitrophenyl)methoxy]silane CAS Name: bis(4-hexadecoxyphenyl)-bis[(2-nitrophenyl)methoxy]silane IUPAC Name: bis(4-hexadecoxyphenyl)-bis[(2-nitrophenyl)methoxy]silane Traditional Name: bis(4-cetyloxyphenyl)-bis[(2-nitrobenzyl)oxy]silane Formula: C58H86N2O8Si MolecularWeight: 967.39754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)[Si](C2=CC=C(C=C2)OCCCCCCCCCCCCCCCC)(OCC3=CC=CC=C3[N+](=O)[O-])OCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)[Si](C2=CC=C(C=C2)OCCCCCCCCCCCCCCCC)(OCC3=CC=CC=C3[N+](=O)[O-])OCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C58H86N2O8Si/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-33-47-65-53-39-43-55(44-40-53)69(67-49-51-35-29-31-37-57(51)59(61)62,68-50-52-36-30-32-38-58(52)60(63)64)56-45-41-54(42-46-56)66-48-34-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-32,35-46H,3-28,33-34,47-50H2,1-2H3