(E)-6-chloranyl-3-methyl-1-[2,6,6-trimethyl-5-(1-oxidanylprop-2-ynyl)cyclohexen-1-yl]hex-2-en-1-one

Systemtic Name: (E)-6-chloranyl-3-methyl-1-[2,6,6-trimethyl-5-(1-oxidanylprop-2-ynyl)cyclohexen-1-yl]hex-2-en-1-one Openeye Name: (E)-6-chloro-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethyl-cyclohexen-1-yl]-3-methyl-hex-2-en-1-one CAS Name: (E)-6-chloro-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethyl-1-cyclohexenyl]-3-methyl-2-hexen-1-one IUPAC Name: (E)-6-chloro-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethylcyclohexen-1-yl]-3-methylhex-2-en-1-one Traditional Name: (E)-6-chloro-1-[5-(1-hydroxyprop-2-ynyl)-2,6,6-trimethyl-cyclohexen-1-yl]-3-methyl-hex-2-en-1-one Formula: C19H27ClO2 MolecularWeight: 322.86948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CC1)C(C#C)O)(C)C)C(=O)C=C(C)CCCCl

Isomeric SMILES

CC1=C(C(C(CC1)C(C#C)O)(C)C)C(=O)/C=C(\C)/CCCCl

InChI

InChI=1S/C19H27ClO2/c1-6-16(21)15-10-9-14(3)18(19(15,4)5)17(22)12-13(2)8-7-11-20/h1,12,15-16,21H,7-11H2,2-5H3/b13-12+