[2-oxidanyl-1,6-diphenyl-2,5-bis(phenylmethoxycarbonylamino)hexan-3-yl] methanesulfonate

Systemtic Name: [2-oxidanyl-1,6-diphenyl-2,5-bis(phenylmethoxycarbonylamino)hexan-3-yl] methanesulfonate Openeye Name: [3-(benzyloxycarbonylamino)-1-[1-(benzyloxycarbonylamino)-1-hydroxy-2-phenyl-ethyl]-4-phenyl-butyl] methanesulfonate CAS Name: methanesulfonic acid [2-hydroxy-1,6-diphenyl-2,5-bis(phenylmethoxycarbonylamino)hexan-3-yl] ester IUPAC Name: [2-hydroxy-1,6-diphenyl-2,5-bis(phenylmethoxycarbonylamino)hexan-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-(benzyloxycarbonylamino)-1-[1-(benzyloxycarbonylamino)-1-hydroxy-2-phenyl-ethyl]-4-phenyl-butyl] ester Formula: C35H38N2O8S MolecularWeight: 646.74982

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CC(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)C(CC3=CC=CC=C3)(NC(=O)OCC4=CC=CC=C4)O

Isomeric SMILES

CS(=O)(=O)OC(CC(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)C(CC3=CC=CC=C3)(NC(=O)OCC4=CC=CC=C4)O

InChI

InChI=1S/C35H38N2O8S/c1-46(41,42)45-32(23-31(22-27-14-6-2-7-15-27)36-33(38)43-25-29-18-10-4-11-19-29)35(40,24-28-16-8-3-9-17-28)37-34(39)44-26-30-20-12-5-13-21-30/h2-21,31-32,40H,22-26H2,1H3,(H,36,38)(H,37,39)