methyl [(3S,4R)-4-(phenylmethoxycarbonylamino)-6-(phenylsulfonyl)hex-1-en-3-yl] carbonate

Systemtic Name: methyl [(3S,4R)-4-(phenylmethoxycarbonylamino)-6-(phenylsulfonyl)hex-1-en-3-yl] carbonate Openeye Name: [(1S,2R)-4-(benzenesulfonyl)-2-(benzyloxycarbonylamino)-1-vinyl-butyl] methyl carbonate CAS Name: carbonic acid [(3S,4R)-6-(benzenesulfonyl)-4-(phenylmethoxycarbonylamino)hex-1-en-3-yl] methyl ester IUPAC Name: [(3S,4R)-6-(benzenesulfonyl)-4-(phenylmethoxycarbonylamino)hex-1-en-3-yl] methyl carbonate Traditional Name: carbonic acid [(1S)-1-[(1R)-1-(benzyloxycarbonylamino)-3-besyl-propyl]allyl] methyl ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC(C=C)C(CCS(=O)(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)O[C@@H](C=C)[C@@H](CCS(=O)(=O)C1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H25NO7S/c1-3-20(30-22(25)28-2)19(14-15-31(26,27)18-12-8-5-9-13-18)23-21(24)29-16-17-10-6-4-7-11-17/h3-13,19-20H,1,14-16H2,2H3,(H,23,24)/t19-,20+/m1/s1