5-(2,4-dichlorophenyl)-4-oxidanyl-4-pyridin-3-yl-hexan-3-one

Systemtic Name: 5-(2,4-dichlorophenyl)-4-oxidanyl-4-pyridin-3-yl-hexan-3-one Openeye Name: 5-(2,4-dichlorophenyl)-4-hydroxy-4-(3-pyridyl)hexan-3-one CAS Name: 5-(2,4-dichlorophenyl)-4-hydroxy-4-(3-pyridinyl)-3-hexanone IUPAC Name: 5-(2,4-dichlorophenyl)-4-hydroxy-4-pyridin-3-ylhexan-3-one Traditional Name: 5-(2,4-dichlorophenyl)-4-hydroxy-4-(3-pyridyl)hexan-3-one Formula: C17H17Cl2NO2 MolecularWeight: 338.22838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C1=CN=CC=C1)(C(C)C2=C(C=C(C=C2)Cl)Cl)O

Isomeric SMILES

CCC(=O)C(C1=CN=CC=C1)(C(C)C2=C(C=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C17H17Cl2NO2/c1-3-16(21)17(22,12-5-4-8-20-10-12)11(2)14-7-6-13(18)9-15(14)19/h4-11,22H,3H2,1-2H3