(4R,5R)-4-(3-methyl-1,2-oxazol-5-yl)-3-oxidanyl-5-phenyl-cyclohex-2-en-1-one

Systemtic Name: (4R,5R)-4-(3-methyl-1,2-oxazol-5-yl)-3-oxidanyl-5-phenyl-cyclohex-2-en-1-one Openeye Name: (4R,5R)-3-hydroxy-4-(3-methylisoxazol-5-yl)-5-phenyl-cyclohex-2-en-1-one CAS Name: (4R,5R)-3-hydroxy-4-(3-methyl-5-isoxazolyl)-5-phenyl-1-cyclohex-2-enone IUPAC Name: (4R,5R)-3-hydroxy-4-(3-methyl-1,2-oxazol-5-yl)-5-phenylcyclohex-2-en-1-one Traditional Name: (4R,5R)-3-hydroxy-4-(3-methylisoxazol-5-yl)-5-phenyl-cyclohex-2-en-1-one Formula: C16H15NO3 MolecularWeight: 269.2952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2C(CC(=O)C=C2O)C3=CC=CC=C3

Isomeric SMILES

CC1=NOC(=C1)[C@@H]2[C@@H](CC(=O)C=C2O)C3=CC=CC=C3

InChI

InChI=1S/C16H15NO3/c1-10-7-15(20-17-10)16-13(8-12(18)9-14(16)19)11-5-3-2-4-6-11/h2-7,9,13,16,19H,8H2,1H3/t13-,16+/m0/s1