6-chloranyl-1-[5-(1,3-dioxolan-2-yl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-yn-1-one

Systemtic Name: 6-chloranyl-1-[5-(1,3-dioxolan-2-yl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-yn-1-one Openeye Name: 6-chloro-1-[5-(1,3-dioxolan-2-yl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-yn-1-one CAS Name: 6-chloro-1-[5-(1,3-dioxolan-2-yl)-2,6,6-trimethyl-1-cyclohexenyl]-2-hexyn-1-one IUPAC Name: 6-chloro-1-[5-(1,3-dioxolan-2-yl)-2,6,6-trimethylcyclohexen-1-yl]hex-2-yn-1-one Traditional Name: 6-chloro-1-[5-(1,3-dioxolan-2-yl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-yn-1-one Formula: C18H25ClO3 MolecularWeight: 324.8423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CC1)C2OCCO2)(C)C)C(=O)C#CCCCCl

Isomeric SMILES

CC1=C(C(C(CC1)C2OCCO2)(C)C)C(=O)C#CCCCCl

InChI

InChI=1S/C18H25ClO3/c1-13-8-9-14(17-21-11-12-22-17)18(2,3)16(13)15(20)7-5-4-6-10-19/h14,17H,4,6,8-12H2,1-3H3