[(3S,4R)-9-chloranyl-4-(phenylmethoxycarbonylamino)non-1-en-3-yl] methyl carbonate

Systemtic Name: [(3S,4R)-9-chloranyl-4-(phenylmethoxycarbonylamino)non-1-en-3-yl] methyl carbonate Openeye Name: [(1S,2R)-2-(benzyloxycarbonylamino)-7-chloro-1-vinyl-heptyl] methyl carbonate CAS Name: carbonic acid [(3S,4R)-9-chloro-4-(phenylmethoxycarbonylamino)non-1-en-3-yl] methyl ester IUPAC Name: [(3S,4R)-9-chloro-4-(phenylmethoxycarbonylamino)non-1-en-3-yl] methyl carbonate Traditional Name: carbonic acid [(1S)-1-[(1R)-1-(benzyloxycarbonylamino)-6-chloro-hexyl]allyl] methyl ester Formula: C19H26ClNO5 MolecularWeight: 383.86644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC(C=C)C(CCCCCCl)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)O[C@@H](C=C)[C@@H](CCCCCCl)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H26ClNO5/c1-3-17(26-19(23)24-2)16(12-8-5-9-13-20)21-18(22)25-14-15-10-6-4-7-11-15/h3-4,6-7,10-11,16-17H,1,5,8-9,12-14H2,2H3,(H,21,22)/t16-,17+/m1/s1