[(2R)-3,3-bis(fluoranyl)-2-(phenylmethoxycarbonylamino)hex-5-enyl] hex-5-enoate

Systemtic Name: [(2R)-3,3-bis(fluoranyl)-2-(phenylmethoxycarbonylamino)hex-5-enyl] hex-5-enoate Openeye Name: [(2R)-2-(benzyloxycarbonylamino)-3,3-difluoro-hex-5-enyl] hex-5-enoate CAS Name: 5-hexenoic acid [(2R)-3,3-difluoro-2-(phenylmethoxycarbonylamino)hex-5-enyl] ester IUPAC Name: [(2R)-3,3-difluoro-2-(phenylmethoxycarbonylamino)hex-5-enyl] hex-5-enoate Traditional Name: hex-5-enoic acid [(2R)-2-(benzyloxycarbonylamino)-3,3-difluoro-hex-5-enyl] ester Formula: C20H25F2NO4 MolecularWeight: 381.413606

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC(=O)OCC(C(CC=C)(F)F)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

C=CCCCC(=O)OC[C@H](C(CC=C)(F)F)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C20H25F2NO4/c1-3-5-7-12-18(24)26-15-17(20(21,22)13-4-2)23-19(25)27-14-16-10-8-6-9-11-16/h3-4,6,8-11,17H,1-2,5,7,12-15H2,(H,23,25)/t17-/m1/s1