1-chloranyl-3-(3-iodanylhex-1-ynyl)benzene

Systemtic Name: 1-chloranyl-3-(3-iodanylhex-1-ynyl)benzene Openeye Name: 1-chloro-3-(3-iodohex-1-ynyl)benzene CAS Name: 1-chloro-3-(3-iodohex-1-ynyl)benzene IUPAC Name: 1-chloro-3-(3-iodohex-1-ynyl)benzene Traditional Name: 1-chloro-3-(3-iodohex-1-ynyl)benzene Formula: C12H12ClI MolecularWeight: 318.58115

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#CC1=CC(=CC=C1)Cl)I

Isomeric SMILES

CCCC(C#CC1=CC(=CC=C1)Cl)I

InChI

InChI=1S/C12H12ClI/c1-2-4-12(14)8-7-10-5-3-6-11(13)9-10/h3,5-6,9,12H,2,4H2,1H3