[(2S,3S)-3-acetyloxy-4,4-dimethyl-1-(phenylmethoxycarbonylamino)hex-5-en-2-yl] ethanoate

Systemtic Name: [(2S,3S)-3-acetyloxy-4,4-dimethyl-1-(phenylmethoxycarbonylamino)hex-5-en-2-yl] ethanoate Openeye Name: [(1S,2S)-2-acetoxy-1-(benzyloxycarbonylaminomethyl)-3,3-dimethyl-pent-4-enyl] acetate CAS Name: acetic acid [(2S,3S)-3-acetyloxy-4,4-dimethyl-1-(phenylmethoxycarbonylamino)hex-5-en-2-yl] ester IUPAC Name: [(2S,3S)-3-acetyloxy-4,4-dimethyl-1-(phenylmethoxycarbonylamino)hex-5-en-2-yl] acetate Traditional Name: acetic acid [(1S,2S)-2-acetoxy-1-(benzyloxycarbonylaminomethyl)-3,3-dimethyl-pent-4-enyl] ester Formula: C20H27NO6 MolecularWeight: 377.43148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CNC(=O)OCC1=CC=CC=C1)C(C(C)(C)C=C)OC(=O)C

Isomeric SMILES

CC(=O)O[C@@H](CNC(=O)OCC1=CC=CC=C1)[C@H](C(C)(C)C=C)OC(=O)C

InChI

InChI=1S/C20H27NO6/c1-6-20(4,5)18(27-15(3)23)17(26-14(2)22)12-21-19(24)25-13-16-10-8-7-9-11-16/h6-11,17-18H,1,12-13H2,2-5H3,(H,21,24)/t17-,18+/m0/s1