[(1S,2E,4S)-2-[(4-bromophenyl)methylidene]-4-chloranyl-cyclobutyl] ethanoate

Systemtic Name: [(1S,2E,4S)-2-[(4-bromophenyl)methylidene]-4-chloranyl-cyclobutyl] ethanoate Openeye Name: [(1S,2E,4S)-2-[(4-bromophenyl)methylene]-4-chloro-cyclobutyl] acetate CAS Name: acetic acid [(1S,2E,4S)-2-[(4-bromophenyl)methylidene]-4-chlorocyclobutyl] ester IUPAC Name: [(1S,2E,4S)-2-[(4-bromophenyl)methylidene]-4-chlorocyclobutyl] acetate Traditional Name: acetic acid [(1S,2E,4S)-2-(4-bromobenzylidene)-4-chloro-cyclobutyl] ester Formula: C13H12BrClO2 MolecularWeight: 315.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(CC1=CC2=CC=C(C=C2)Br)Cl

Isomeric SMILES

CC(=O)O[C@@H]\1[C@H](C/C1=C\C2=CC=C(C=C2)Br)Cl

InChI

InChI=1S/C13H12BrClO2/c1-8(16)17-13-10(7-12(13)15)6-9-2-4-11(14)5-3-9/h2-6,12-13H,7H2,1H3/b10-6+/t12-,13-/m0/s1