6-methyl-1-(3-methyl-2-prop-2-enyl-phenyl)undec-2-yn-1-one

Systemtic Name: 6-methyl-1-(3-methyl-2-prop-2-enyl-phenyl)undec-2-yn-1-one Openeye Name: 1-(2-allyl-3-methyl-phenyl)-6-methyl-undec-2-yn-1-one CAS Name: 6-methyl-1-(3-methyl-2-prop-2-enylphenyl)-2-undecyn-1-one IUPAC Name: 6-methyl-1-(3-methyl-2-prop-2-enylphenyl)undec-2-yn-1-one Traditional Name: 1-(2-allyl-3-methyl-phenyl)-6-methyl-undec-2-yn-1-one Formula: C22H30O MolecularWeight: 310.473

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CCC#CC(=O)C1=C(C(=CC=C1)C)CC=C

Isomeric SMILES

CCCCCC(C)CCC#CC(=O)C1=C(C(=CC=C1)C)CC=C

InChI

InChI=1S/C22H30O/c1-5-7-8-13-18(3)14-9-10-17-22(23)21-16-11-15-19(4)20(21)12-6-2/h6,11,15-16,18H,2,5,7-9,12-14H2,1,3-4H3