2-[2-adamantylidene-[3-[tert-butyl(diphenyl)silyl]oxyphenyl]methoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[2-adamantylidene-[3-[tert-butyl(diphenyl)silyl]oxyphenyl]methoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[2-adamantylidene-[3-[tert-butyl(diphenyl)silyl]oxyphenyl]methoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[2-adamantylidene-[3-[tert-butyl(diphenyl)silyl]oxyphenyl]methoxy]ethyl ester IUPAC Name: 2-[2-adamantylidene-[3-[tert-butyl(diphenyl)silyl]oxyphenyl]methoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[2-adamantylidene-[3-[tert-butyl(diphenyl)silyl]oxyphenyl]methoxy]ethyl ester Formula: C42H48O5SSi MolecularWeight: 692.97802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC(=C2C3CC4CC(C3)CC2C4)C5=CC(=CC=C5)O[Si](C6=CC=CC=C6)(C7=CC=CC=C7)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC(=C2C3CC4CC(C3)CC2C4)C5=CC(=CC=C5)O[Si](C6=CC=CC=C6)(C7=CC=CC=C7)C(C)(C)C

InChI

InChI=1S/C42H48O5SSi/c1-30-18-20-37(21-19-30)48(43,44)46-23-22-45-41(40-34-25-31-24-32(27-34)28-35(40)26-31)33-12-11-13-36(29-33)47-49(42(2,3)4,38-14-7-5-8-15-38)39-16-9-6-10-17-39/h5-21,29,31-32,34-35H,22-28H2,1-4H3