2-methyl-2-(phenylmethyl)cyclopentane-1,3-dione

Systemtic Name: 2-methyl-2-(phenylmethyl)cyclopentane-1,3-dione Openeye Name: 2-benzyl-2-methyl-cyclopentane-1,3-dione CAS Name: 2-methyl-2-(phenylmethyl)cyclopentane-1,3-dione IUPAC Name: 2-benzyl-2-methylcyclopentane-1,3-dione Traditional Name: 2-benzyl-2-methyl-cyclopentane-1,3-quinone Formula: C13H14O2 MolecularWeight: 202.24906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)CCC1=O)CC2=CC=CC=C2

Isomeric SMILES

CC1(C(=O)CCC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C13H14O2/c1-13(11(14)7-8-12(13)15)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3