[(4S,6S,10S)-10-azanyl-12-[tert-butyl(diphenyl)silyl]oxy-4-phenylmethoxy-dodecan-6-yl] methanesulfonate

Systemtic Name: [(4S,6S,10S)-10-azanyl-12-[tert-butyl(diphenyl)silyl]oxy-4-phenylmethoxy-dodecan-6-yl] methanesulfonate Openeye Name: [(1S,5S)-5-amino-1-[(2S)-2-benzyloxypentyl]-7-[tert-butyl(diphenyl)silyl]oxy-heptyl] methanesulfonate CAS Name: methanesulfonic acid [(4S,6S,10S)-10-amino-12-[tert-butyl(diphenyl)silyl]oxy-4-phenylmethoxydodecan-6-yl] ester IUPAC Name: [(4S,6S,10S)-10-amino-12-[tert-butyl(diphenyl)silyl]oxy-4-phenylmethoxydodecan-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1S,5S)-5-amino-1-[(2S)-2-benzoxypentyl]-7-[tert-butyl(diphenyl)silyl]oxy-heptyl] ester Formula: C36H53NO5SSi MolecularWeight: 639.96022

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(CCCC(CCO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)N)OS(=O)(=O)C)OCC3=CC=CC=C3

Isomeric SMILES

CCC[C@@H](C[C@H](CCC[C@@H](CCO[Si](C1=CC=CC=C1)(C2=CC=CC=C2)C(C)(C)C)N)OS(=O)(=O)C)OCC3=CC=CC=C3

InChI

InChI=1S/C36H53NO5SSi/c1-6-17-32(40-29-30-18-10-7-11-19-30)28-33(42-43(5,38)39)21-16-20-31(37)26-27-41-44(36(2,3)4,34-22-12-8-13-23-34)35-24-14-9-15-25-35/h7-15,18-19,22-25,31-33H,6,16-17,20-21,26-29,37H2,1-5H3/t31-,32-,33-/m0/s1