[(2S)-1-bromanyloct-7-en-2-yl] (2S)-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [(2S)-1-bromanyloct-7-en-2-yl] (2S)-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [(1S)-1-(bromomethyl)hept-6-enyl] (2S)-2-hydroxy-2-phenyl-acetate CAS Name: (2S)-2-hydroxy-2-phenylacetic acid [(2S)-1-bromooct-7-en-2-yl] ester IUPAC Name: [(2S)-1-bromooct-7-en-2-yl] (2S)-2-hydroxy-2-phenylacetate Traditional Name: (2S)-2-hydroxy-2-phenyl-acetic acid [(1S)-1-(bromomethyl)hept-6-enyl] ester Formula: C16H21BrO3 MolecularWeight: 341.24014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrO3/c1-2-3-4-8-11-14(12-17)20-16(19)15(18)13-9-6-5-7-10-13/h2,5-7,9-10,14-15,18H,1,3-4,8,11-12H2/t14-,15-/m0/s1