4-imidazol-1-yl-1-(2,3,5,6-tetramethylphenyl)butan-2-one

Systemtic Name: 4-imidazol-1-yl-1-(2,3,5,6-tetramethylphenyl)butan-2-one Openeye Name: 4-imidazol-1-yl-1-(2,3,5,6-tetramethylphenyl)butan-2-one CAS Name: 4-(1-imidazolyl)-1-(2,3,5,6-tetramethylphenyl)-2-butanone IUPAC Name: 4-imidazol-1-yl-1-(2,3,5,6-tetramethylphenyl)butan-2-one Traditional Name: 4-imidazol-1-yl-1-(2,3,5,6-tetramethylphenyl)butan-2-one Formula: C17H22N2O MolecularWeight: 270.36938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)CC(=O)CCN2C=CN=C2)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)CC(=O)CCN2C=CN=C2)C)C

InChI

InChI=1S/C17H22N2O/c1-12-9-13(2)15(4)17(14(12)3)10-16(20)5-7-19-8-6-18-11-19/h6,8-9,11H,5,7,10H2,1-4H3