tert-butyl-[(4R,5S)-8-isocyano-5-methyl-8-(4-methylphenyl)sulfonyl-1-phenylmethoxy-octan-4-yl]oxy-dimethyl-silane

Systemtic Name: tert-butyl-[(4R,5S)-8-isocyano-5-methyl-8-(4-methylphenyl)sulfonyl-1-phenylmethoxy-octan-4-yl]oxy-dimethyl-silane Openeye Name: [(1R,2S)-1-(3-benzyloxypropyl)-5-isocyano-2-methyl-5-(p-tolylsulfonyl)pentoxy]-tert-butyl-dimethyl-silane CAS Name: tert-butyl-[(4R,5S)-8-isocyano-5-methyl-8-(4-methylphenyl)sulfonyl-1-phenylmethoxyoctan-4-yl]oxy-dimethylsilane IUPAC Name: tert-butyl-[(4R,5S)-8-isocyano-5-methyl-8-(4-methylphenyl)sulfonyl-1-phenylmethoxyoctan-4-yl]oxy-dimethylsilane Traditional Name: [(1R,2S)-1-(3-benzoxypropyl)-5-isocyano-2-methyl-5-tosyl-pentoxy]-tert-butyl-dimethyl-silane Formula: C30H45NO4SSi MolecularWeight: 543.8331

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CCC(C)C(CCCOCC2=CC=CC=C2)O[Si](C)(C)C(C)(C)C)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC[C@H](C)[C@@H](CCCOCC2=CC=CC=C2)O[Si](C)(C)C(C)(C)C)[N+]#[C-]

InChI

InChI=1S/C30H45NO4SSi/c1-24-16-19-27(20-17-24)36(32,33)29(31-6)21-18-25(2)28(35-37(7,8)30(3,4)5)15-12-22-34-23-26-13-10-9-11-14-26/h9-11,13-14,16-17,19-20,25,28-29H,12,15,18,21-23H2,1-5,7-8H3/t25-,28+,29?/m0/s1