1-(3-but-3-ynyl-2,2,4-trimethyl-cyclohex-3-en-1-yl)hepta-2,6-diyn-1-one

Systemtic Name: 1-(3-but-3-ynyl-2,2,4-trimethyl-cyclohex-3-en-1-yl)hepta-2,6-diyn-1-one Openeye Name: 1-(3-but-3-ynyl-2,2,4-trimethyl-cyclohex-3-en-1-yl)hepta-2,6-diyn-1-one CAS Name: 1-(3-but-3-ynyl-2,2,4-trimethyl-1-cyclohex-3-enyl)-1-hepta-2,6-diynone IUPAC Name: 1-(3-but-3-ynyl-2,2,4-trimethylcyclohex-3-en-1-yl)hepta-2,6-diyn-1-one Traditional Name: 1-(3-but-3-ynyl-2,2,4-trimethyl-cyclohex-3-en-1-yl)hepta-2,6-diyn-1-one Formula: C20H24O MolecularWeight: 280.40396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CC1)C(=O)C#CCCC#C)(C)C)CCC#C

Isomeric SMILES

CC1=C(C(C(CC1)C(=O)C#CCCC#C)(C)C)CCC#C

InChI

InChI=1S/C20H24O/c1-6-8-10-11-13-19(21)18-15-14-16(3)17(12-9-7-2)20(18,4)5/h1-2,18H,8-10,12,14-15H2,3-5H3