(E)-4-(2-chloranyl-4-propan-2-yl-phenyl)but-3-en-2-one

Systemtic Name: (E)-4-(2-chloranyl-4-propan-2-yl-phenyl)but-3-en-2-one Openeye Name: (E)-4-(2-chloro-4-isopropyl-phenyl)but-3-en-2-one CAS Name: (E)-4-(2-chloro-4-propan-2-ylphenyl)-3-buten-2-one IUPAC Name: (E)-4-(2-chloro-4-propan-2-ylphenyl)but-3-en-2-one Traditional Name: (E)-4-(2-chloro-4-isopropyl-phenyl)but-3-en-2-one Formula: C13H15ClO MolecularWeight: 222.7106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClO/c1-9(2)12-7-6-11(13(14)8-12)5-4-10(3)15/h4-9H,1-3H3/b5-4+