methyl (1S,2S,3R)-2-(4-bromophenyl)-1-ethanoyl-3-methanoyl-cyclopropane-1-carboxylate

Systemtic Name: methyl (1S,2S,3R)-2-(4-bromophenyl)-1-ethanoyl-3-methanoyl-cyclopropane-1-carboxylate Openeye Name: methyl (1S,2S,3R)-1-acetyl-2-(4-bromophenyl)-3-formyl-cyclopropanecarboxylate CAS Name: (1S,2S,3R)-1-acetyl-2-(4-bromophenyl)-3-formyl-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2S,3R)-1-acetyl-2-(4-bromophenyl)-3-formylcyclopropane-1-carboxylate Traditional Name: (1S,2S,3R)-1-acetyl-2-(4-bromophenyl)-3-formyl-cyclopropanecarboxylic acid methyl ester Formula: C14H13BrO4 MolecularWeight: 325.15462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C(C1C2=CC=C(C=C2)Br)C=O)C(=O)OC

Isomeric SMILES

CC(=O)[C@]1([C@@H]([C@H]1C2=CC=C(C=C2)Br)C=O)C(=O)OC

InChI

InChI=1S/C14H13BrO4/c1-8(17)14(13(18)19-2)11(7-16)12(14)9-3-5-10(15)6-4-9/h3-7,11-12H,1-2H3/t11-,12-,14-/m1/s1