(4,5-dimethyl-2-nitro-phenyl)methoxy-tris(4-hexadecoxyphenyl)silane

Systemtic Name: (4,5-dimethyl-2-nitro-phenyl)methoxy-tris(4-hexadecoxyphenyl)silane Openeye Name: (4,5-dimethyl-2-nitro-phenyl)methoxy-tris(4-hexadecoxyphenyl)silane CAS Name: (4,5-dimethyl-2-nitrophenyl)methoxy-tris(4-hexadecoxyphenyl)silane IUPAC Name: (4,5-dimethyl-2-nitrophenyl)methoxy-tris(4-hexadecoxyphenyl)silane Traditional Name: tris(4-cetyloxyphenyl)-(4,5-dimethyl-2-nitro-benzyl)oxy-silane Formula: C75H121NO6Si MolecularWeight: 1160.85184

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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)C)C)[N+](=O)[O-]

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)C)C)[N+](=O)[O-]

InChI

InChI=1S/C75H121NO6Si/c1-6-9-12-15-18-21-24-27-30-33-36-39-42-45-60-79-69-48-54-72(55-49-69)83(82-65-68-63-66(4)67(5)64-75(68)76(77)78,73-56-50-70(51-57-73)80-61-46-43-40-37-34-31-28-25-22-19-16-13-10-7-2)74-58-52-71(53-59-74)81-62-47-44-41-38-35-32-29-26-23-20-17-14-11-8-3/h48-59,63-64H,6-47,60-62,65H2,1-5H3