[(3S,4S)-4-methanoyl-4-methyl-1-phenylmethoxy-hex-5-en-3-yl] 2-bromanylethanoate

Systemtic Name: [(3S,4S)-4-methanoyl-4-methyl-1-phenylmethoxy-hex-5-en-3-yl] 2-bromanylethanoate Openeye Name: [(1S,2S)-1-(2-benzyloxyethyl)-2-formyl-2-methyl-but-3-enyl] 2-bromoacetate CAS Name: 2-bromoacetic acid [(3S,4S)-4-formyl-4-methyl-1-phenylmethoxyhex-5-en-3-yl] ester IUPAC Name: [(3S,4S)-4-formyl-4-methyl-1-phenylmethoxyhex-5-en-3-yl] 2-bromoacetate Traditional Name: 2-bromoacetic acid [(1S,2S)-1-(2-benzoxyethyl)-2-formyl-2-methyl-but-3-enyl] ester Formula: C17H21BrO4 MolecularWeight: 369.25024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)(C=O)C(CCOCC1=CC=CC=C1)OC(=O)CBr

Isomeric SMILES

C[C@@](C=C)(C=O)[C@H](CCOCC1=CC=CC=C1)OC(=O)CBr

InChI

InChI=1S/C17H21BrO4/c1-3-17(2,13-19)15(22-16(20)11-18)9-10-21-12-14-7-5-4-6-8-14/h3-8,13,15H,1,9-12H2,2H3/t15-,17+/m0/s1