2-methyl-2-(1-phenylprop-2-ynyl)cyclohexane-1,3-dione

Systemtic Name: 2-methyl-2-(1-phenylprop-2-ynyl)cyclohexane-1,3-dione Openeye Name: 2-methyl-2-(1-phenylprop-2-ynyl)cyclohexane-1,3-dione CAS Name: 2-methyl-2-(1-phenylprop-2-ynyl)cyclohexane-1,3-dione IUPAC Name: 2-methyl-2-(1-phenylprop-2-ynyl)cyclohexane-1,3-dione Traditional Name: 2-methyl-2-(1-phenylprop-2-ynyl)cyclohexane-1,3-quinone Formula: C16H16O2 MolecularWeight: 240.29704

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)CCCC1=O)C(C#C)C2=CC=CC=C2

Isomeric SMILES

CC1(C(=O)CCCC1=O)C(C#C)C2=CC=CC=C2

InChI

InChI=1S/C16H16O2/c1-3-13(12-8-5-4-6-9-12)16(2)14(17)10-7-11-15(16)18/h1,4-6,8-9,13H,7,10-11H2,2H3