[(4S,5S,6R)-7-azido-5,6-bis(phenylmethoxy)hept-1-en-4-yl] methanesulfonate

Systemtic Name: [(4S,5S,6R)-7-azido-5,6-bis(phenylmethoxy)hept-1-en-4-yl] methanesulfonate Openeye Name: [(1S)-1-[(1S,2R)-3-azido-1,2-dibenzyloxy-propyl]but-3-enyl] methanesulfonate CAS Name: methanesulfonic acid [(4S,5S,6R)-7-azido-5,6-bis(phenylmethoxy)hept-1-en-4-yl] ester IUPAC Name: [(4S,5S,6R)-7-azido-5,6-bis(phenylmethoxy)hept-1-en-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1S)-1-[(1S,2R)-3-azido-1,2-dibenzoxy-propyl]but-3-enyl] ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CC=C)C(C(CN=[N+]=[N-])OCC1=CC=CC=C1)OCC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)O[C@@H](CC=C)[C@H]([C@@H](CN=[N+]=[N-])OCC1=CC=CC=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27N3O5S/c1-3-10-20(30-31(2,26)27)22(29-17-19-13-8-5-9-14-19)21(15-24-25-23)28-16-18-11-6-4-7-12-18/h3-9,11-14,20-22H,1,10,15-17H2,2H3/t20-,21+,22+/m0/s1