3-[(4-chlorophenyl)-oxidanyl-methylidene]-4-methyl-pentan-2-one

Systemtic Name: 3-[(4-chlorophenyl)-oxidanyl-methylidene]-4-methyl-pentan-2-one Openeye Name: 3-[(4-chlorophenyl)-hydroxy-methylene]-4-methyl-pentan-2-one CAS Name: 3-[(4-chlorophenyl)-hydroxymethylidene]-4-methyl-2-pentanone IUPAC Name: 3-[(4-chlorophenyl)-hydroxymethylidene]-4-methylpentan-2-one Traditional Name: 4-(4-chlorophenyl)-4-hydroxy-3-isopropyl-but-3-en-2-one Formula: C13H15ClO2 MolecularWeight: 238.71

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(C1=CC=C(C=C1)Cl)O)C(=O)C

Isomeric SMILES

CC(C)C(=C(C1=CC=C(C=C1)Cl)O)C(=O)C

InChI

InChI=1S/C13H15ClO2/c1-8(2)12(9(3)15)13(16)10-4-6-11(14)7-5-10/h4-8,16H,1-3H3