tris[(2,6-diphenylphenyl)methyl]silyl 4-phenylbutanoate

Systemtic Name: tris[(2,6-diphenylphenyl)methyl]silyl 4-phenylbutanoate Openeye Name: tris[(2,6-diphenylphenyl)methyl]silyl 4-phenylbutanoate CAS Name: 4-phenylbutanoic acid tris[(2,6-diphenylphenyl)methyl]silyl ester IUPAC Name: tris[(2,6-diphenylphenyl)methyl]silyl 4-phenylbutanoate Traditional Name: 4-phenylbutyric acid tris(2,6-diphenylbenzyl)silyl ester Formula: C67H56O2Si MolecularWeight: 921.24584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(=O)O[Si](CC2=C(C=CC=C2C3=CC=CC=C3)C4=CC=CC=C4)(CC5=C(C=CC=C5C6=CC=CC=C6)C7=CC=CC=C7)CC8=C(C=CC=C8C9=CC=CC=C9)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)CCCC(=O)O[Si](CC2=C(C=CC=C2C3=CC=CC=C3)C4=CC=CC=C4)(CC5=C(C=CC=C5C6=CC=CC=C6)C7=CC=CC=C7)CC8=C(C=CC=C8C9=CC=CC=C9)C1=CC=CC=C1

InChI

InChI=1S/C67H56O2Si/c68-67(47-22-28-51-26-8-1-9-27-51)69-70(48-64-58(52-29-10-2-11-30-52)41-23-42-59(64)53-31-12-3-13-32-53,49-65-60(54-33-14-4-15-34-54)43-24-44-61(65)55-35-16-5-17-36-55)50-66-62(56-37-18-6-19-38-56)45-25-46-63(66)57-39-20-7-21-40-57/h1-21,23-27,29-46H,22,28,47-50H2