[(E)-6-chloranylhex-5-en-3-ynyl] benzoate

Systemtic Name: [(E)-6-chloranylhex-5-en-3-ynyl] benzoate Openeye Name: [(E)-6-chlorohex-5-en-3-ynyl] benzoate CAS Name: benzoic acid [(E)-6-chlorohex-5-en-3-ynyl] ester IUPAC Name: [(E)-6-chlorohex-5-en-3-ynyl] benzoate Traditional Name: benzoic acid [(E)-6-chlorohex-5-en-3-ynyl] ester Formula: C13H11ClO2 MolecularWeight: 234.67824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCC#CC=CCl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCC#C/C=C/Cl

InChI

InChI=1S/C13H11ClO2/c14-10-6-1-2-7-11-16-13(15)12-8-4-3-5-9-12/h3-6,8-10H,7,11H2/b10-6+