tris(4-hexadecoxyphenyl)-[(2,3,4-trimethoxy-6-nitro-phenyl)methoxy]silane

Systemtic Name: tris(4-hexadecoxyphenyl)-[(2,3,4-trimethoxy-6-nitro-phenyl)methoxy]silane Openeye Name: tris(4-hexadecoxyphenyl)-[(2,3,4-trimethoxy-6-nitro-phenyl)methoxy]silane CAS Name: tris(4-hexadecoxyphenyl)-[(2,3,4-trimethoxy-6-nitrophenyl)methoxy]silane IUPAC Name: tris(4-hexadecoxyphenyl)-[(2,3,4-trimethoxy-6-nitrophenyl)methoxy]silane Traditional Name: tris(4-cetyloxyphenyl)-(2,3,4-trimethoxy-6-nitro-benzyl)oxy-silane Formula: C76H123NO9Si MolecularWeight: 1222.87662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C76H123NO9Si/c1-7-10-13-16-19-22-25-28-31-34-37-40-43-46-61-83-66-49-55-69(56-50-66)87(86-65-72-73(77(78)79)64-74(80-4)76(82-6)75(72)81-5,70-57-51-67(52-58-70)84-62-47-44-41-38-35-32-29-26-23-20-17-14-11-8-2)71-59-53-68(54-60-71)85-63-48-45-42-39-36-33-30-27-24-21-18-15-12-9-3/h49-60,64H,7-48,61-63,65H2,1-6H3