[(5S)-2-oxidanyl-5-(phenylmethoxycarbonylamino)octyl] methanesulfonate

Systemtic Name: [(5S)-2-oxidanyl-5-(phenylmethoxycarbonylamino)octyl] methanesulfonate Openeye Name: [(5S)-5-(benzyloxycarbonylamino)-2-hydroxy-octyl] methanesulfonate CAS Name: methanesulfonic acid [(5S)-2-hydroxy-5-(phenylmethoxycarbonylamino)octyl] ester IUPAC Name: [(5S)-2-hydroxy-5-(phenylmethoxycarbonylamino)octyl] methanesulfonate Traditional Name: methanesulfonic acid [(5S)-5-(benzyloxycarbonylamino)-2-hydroxy-octyl] ester Formula: C17H27NO6S MolecularWeight: 373.46438

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(COS(=O)(=O)C)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC[C@@H](CCC(COS(=O)(=O)C)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H27NO6S/c1-3-7-15(10-11-16(19)13-24-25(2,21)22)18-17(20)23-12-14-8-5-4-6-9-14/h4-6,8-9,15-16,19H,3,7,10-13H2,1-2H3,(H,18,20)/t15-,16?/m0/s1