(1S,6R)-6-(4-bromophenyl)carbonylcyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-(4-bromophenyl)carbonylcyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-(4-bromobenzoyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[(4-bromophenyl)-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-(4-bromobenzoyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-(4-bromobenzoyl)cyclohex-3-ene-1-carboxylate Formula: C14H12BrO3- MolecularWeight: 308.14728

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

C1C=CC[C@@H]([C@@H]1C(=O)C2=CC=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C14H13BrO3/c15-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)14(17)18/h1-2,5-8,11-12H,3-4H2,(H,17,18)/p-1/t11-,12+/m1/s1