1-[4-chloranyl-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-propanoyl-phenyl]propan-1-one

Systemtic Name: 1-[4-chloranyl-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-propanoyl-phenyl]propan-1-one Openeye Name: 1-[4-chloro-2-(4,4-dimethyl-5H-oxazol-2-yl)-3-propanoyl-phenyl]propan-1-one CAS Name: 1-[4-chloro-2-(4,4-dimethyl-5H-oxazol-2-yl)-3-(1-oxopropyl)phenyl]-1-propanone IUPAC Name: 1-[4-chloro-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-propanoylphenyl]propan-1-one Traditional Name: 1-[4-chloro-2-(4,4-dimethyl-2-oxazolin-2-yl)-3-propionyl-phenyl]propan-1-one Formula: C17H20ClNO3 MolecularWeight: 321.7986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(=C(C=C1)Cl)C(=O)CC)C2=NC(CO2)(C)C

Isomeric SMILES

CCC(=O)C1=C(C(=C(C=C1)Cl)C(=O)CC)C2=NC(CO2)(C)C

InChI

InChI=1S/C17H20ClNO3/c1-5-12(20)10-7-8-11(18)15(13(21)6-2)14(10)16-19-17(3,4)9-22-16/h7-8H,5-6,9H2,1-4H3