2-(4-methoxy-3-methyl-phenyl)-2-methyl-cyclopentane-1,3-dione

Systemtic Name: 2-(4-methoxy-3-methyl-phenyl)-2-methyl-cyclopentane-1,3-dione Openeye Name: 2-(4-methoxy-3-methyl-phenyl)-2-methyl-cyclopentane-1,3-dione CAS Name: 2-(4-methoxy-3-methylphenyl)-2-methylcyclopentane-1,3-dione IUPAC Name: 2-(4-methoxy-3-methylphenyl)-2-methylcyclopentane-1,3-dione Traditional Name: 2-(4-methoxy-3-methyl-phenyl)-2-methyl-cyclopentane-1,3-quinone Formula: C14H16O3 MolecularWeight: 232.27504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(C(=O)CCC2=O)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2(C(=O)CCC2=O)C)OC

InChI

InChI=1S/C14H16O3/c1-9-8-10(4-5-11(9)17-3)14(2)12(15)6-7-13(14)16/h4-5,8H,6-7H2,1-3H3