[(1S,6S)-6-bromanyl-6-methanoyl-cyclohex-2-en-1-yl] (2R)-2-methoxy-2-phenyl-ethanoate

Systemtic Name: [(1S,6S)-6-bromanyl-6-methanoyl-cyclohex-2-en-1-yl] (2R)-2-methoxy-2-phenyl-ethanoate Openeye Name: [(1S,6S)-6-bromo-6-formyl-cyclohex-2-en-1-yl] (2R)-2-methoxy-2-phenyl-acetate CAS Name: (2R)-2-methoxy-2-phenylacetic acid [(1S,6S)-6-bromo-6-formyl-1-cyclohex-2-enyl] ester IUPAC Name: [(1S,6S)-6-bromo-6-formylcyclohex-2-en-1-yl] (2R)-2-methoxy-2-phenylacetate Traditional Name: (2R)-2-methoxy-2-phenyl-acetic acid [(1S,6S)-6-bromo-6-formyl-cyclohex-2-en-1-yl] ester Formula: C16H17BrO4 MolecularWeight: 353.20778

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1)C(=O)OC2C=CCCC2(C=O)Br

Isomeric SMILES

CO[C@H](C1=CC=CC=C1)C(=O)O[C@H]2C=CCC[C@]2(C=O)Br

InChI

InChI=1S/C16H17BrO4/c1-20-14(12-7-3-2-4-8-12)15(19)21-13-9-5-6-10-16(13,17)11-18/h2-5,7-9,11,13-14H,6,10H2,1H3/t13-,14+,16+/m0/s1