(E)-6-bromanyl-1-[2,6,6-trimethyl-5-(1-oxidanylprop-2-ynyl)cyclohexen-1-yl]hex-2-en-1-one

Systemtic Name: (E)-6-bromanyl-1-[2,6,6-trimethyl-5-(1-oxidanylprop-2-ynyl)cyclohexen-1-yl]hex-2-en-1-one Openeye Name: (E)-6-bromo-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-en-1-one CAS Name: (E)-6-bromo-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethyl-1-cyclohexenyl]-2-hexen-1-one IUPAC Name: (E)-6-bromo-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethylcyclohexen-1-yl]hex-2-en-1-one Traditional Name: (E)-6-bromo-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethyl-cyclohexen-1-yl]hex-2-en-1-one Formula: C18H25BrO2 MolecularWeight: 353.2939

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CC1)C(C#C)O)(C)C)C(=O)C=CCCCBr

Isomeric SMILES

CC1=C(C(C(CC1)C(C#C)O)(C)C)C(=O)/C=C/CCCBr

InChI

InChI=1S/C18H25BrO2/c1-5-15(20)14-11-10-13(2)17(18(14,3)4)16(21)9-7-6-8-12-19/h1,7,9,14-15,20H,6,8,10-12H2,2-4H3/b9-7+