3,3-dimethylcycloheptan-1-one; 4,4-dimethylcycloheptan-1-one

Systemtic Name: 3,3-dimethylcycloheptan-1-one; 4,4-dimethylcycloheptan-1-one Openeye Name: 3,3-dimethylcycloheptanone; 4,4-dimethylcycloheptanone CAS Name: 3,3-dimethyl-1-cycloheptanone; 4,4-dimethyl-1-cycloheptanone IUPAC Name: 3,3-dimethylcycloheptan-1-one; 4,4-dimethylcycloheptan-1-one Traditional Name: 3,3-dimethylcycloheptanone; 4,4-dimethylcycloheptanone Formula: C18H32O2 MolecularWeight: 280.44548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(=O)CC1)C.CC1(CCCCC(=O)C1)C

Isomeric SMILES

CC1(CCCC(=O)CC1)C.CC1(CCCCC(=O)C1)C

InChI

InChI=1S/2C9H16O/c1-9(2)6-3-4-8(10)5-7-9;1-9(2)6-4-3-5-8(10)7-9/h2*3-7H2,1-2H3