methyl (6S)-6-(2-bromanyl-3-methanoyl-6-methoxy-phenoxy)cyclohexene-1-carboxylate

Systemtic Name: methyl (6S)-6-(2-bromanyl-3-methanoyl-6-methoxy-phenoxy)cyclohexene-1-carboxylate Openeye Name: methyl (6S)-6-(2-bromo-3-formyl-6-methoxy-phenoxy)cyclohexene-1-carboxylate CAS Name: (6S)-6-(2-bromo-3-formyl-6-methoxyphenoxy)-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (6S)-6-(2-bromo-3-formyl-6-methoxyphenoxy)cyclohexene-1-carboxylate Traditional Name: (6S)-6-(2-bromo-3-formyl-6-methoxy-phenoxy)cyclohexene-1-carboxylic acid methyl ester Formula: C16H17BrO5 MolecularWeight: 369.20718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=O)Br)OC2CCCC=C2C(=O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C=O)Br)O[C@H]2CCCC=C2C(=O)OC

InChI

InChI=1S/C16H17BrO5/c1-20-13-8-7-10(9-18)14(17)15(13)22-12-6-4-3-5-11(12)16(19)21-2/h5,7-9,12H,3-4,6H2,1-2H3/t12-/m0/s1