1-[1-(2,4-dimethylphenyl)ethyl]-2,4-dimethyl-benzene; propan-2-one

Systemtic Name: 1-[1-(2,4-dimethylphenyl)ethyl]-2,4-dimethyl-benzene; propan-2-one Openeye Name: acetone; 1-[1-(2,4-dimethylphenyl)ethyl]-2,4-dimethyl-benzene CAS Name: 1-[1-(2,4-dimethylphenyl)ethyl]-2,4-dimethylbenzene; 2-propanone IUPAC Name: 1-[1-(2,4-dimethylphenyl)ethyl]-2,4-dimethylbenzene; propan-2-one Traditional Name: acetone; 1-[1-(2,4-dimethylphenyl)ethyl]-2,4-dimethyl-benzene Formula: C21H28O MolecularWeight: 296.44642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C2=C(C=C(C=C2)C)C)C.CC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C2=C(C=C(C=C2)C)C)C.CC(=O)C

InChI

InChI=1S/C18H22.C3H6O/c1-12-6-8-17(14(3)10-12)16(5)18-9-7-13(2)11-15(18)4;1-3(2)4/h6-11,16H,1-5H3;1-2H3