(4S)-5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)-3-oxidanyl-2-propanoyl-cyclohex-2-en-1-one

Systemtic Name: (4S)-5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)-3-oxidanyl-2-propanoyl-cyclohex-2-en-1-one Openeye Name: (4S)-3-hydroxy-5,5-dimethyl-4-(3-methylisoxazol-5-yl)-2-propanoyl-cyclohex-2-en-1-one CAS Name: (4S)-3-hydroxy-5,5-dimethyl-4-(3-methyl-5-isoxazolyl)-2-(1-oxopropyl)-1-cyclohex-2-enone IUPAC Name: (4S)-3-hydroxy-5,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)-2-propanoylcyclohex-2-en-1-one Traditional Name: (4S)-3-hydroxy-5,5-dimethyl-4-(3-methylisoxazol-5-yl)-2-propionyl-cyclohex-2-en-1-one Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(C(CC1=O)(C)C)C2=CC(=NO2)C)O

Isomeric SMILES

CCC(=O)C1=C([C@H](C(CC1=O)(C)C)C2=CC(=NO2)C)O

InChI

InChI=1S/C15H19NO4/c1-5-9(17)12-10(18)7-15(3,4)13(14(12)19)11-6-8(2)16-20-11/h6,13,19H,5,7H2,1-4H3/t13-/m1/s1