6-chloranyl-1-[2,6,6-trimethyl-5-(1-oxidanylprop-2-enyl)cyclohexen-1-yl]hex-2-yn-1-one

Systemtic Name: 6-chloranyl-1-[2,6,6-trimethyl-5-(1-oxidanylprop-2-enyl)cyclohexen-1-yl]hex-2-yn-1-one Openeye Name: 6-chloro-1-[5-(1-hydroxyallyl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-yn-1-one CAS Name: 6-chloro-1-[5-(1-hydroxyprop-2-enyl)-2,6,6-trimethyl-1-cyclohexenyl]-2-hexyn-1-one IUPAC Name: 6-chloro-1-[5-(1-hydroxyprop-2-enyl)-2,6,6-trimethylcyclohexen-1-yl]hex-2-yn-1-one Traditional Name: 6-chloro-1-[5-(1-hydroxyallyl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-yn-1-one Formula: C18H25ClO2 MolecularWeight: 308.8429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CC1)C(C=C)O)(C)C)C(=O)C#CCCCCl

Isomeric SMILES

CC1=C(C(C(CC1)C(C=C)O)(C)C)C(=O)C#CCCCCl

InChI

InChI=1S/C18H25ClO2/c1-5-15(20)14-11-10-13(2)17(18(14,3)4)16(21)9-7-6-8-12-19/h5,14-15,20H,1,6,8,10-12H2,2-4H3