5,5-dimethyl-2,2-bis(prop-2-ynyl)cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2,2-bis(prop-2-ynyl)cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2,2-bis(prop-2-ynyl)cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2,2-bis(prop-2-ynyl)cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2,2-bis(prop-2-ynyl)cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2,2-dipropargyl-cyclohexane-1,3-quinone Formula: C14H16O2 MolecularWeight: 216.27564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)(CC#C)CC#C)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)(CC#C)CC#C)C

InChI

InChI=1S/C14H16O2/c1-5-7-14(8-6-2)11(15)9-13(3,4)10-12(14)16/h1-2H,7-10H2,3-4H3