(4R)-4-oxidanyl-4-(2,3,4,5,6-pentamethylphenyl)butanoate

Systemtic Name: (4R)-4-oxidanyl-4-(2,3,4,5,6-pentamethylphenyl)butanoate Openeye Name: (4R)-4-hydroxy-4-(2,3,4,5,6-pentamethylphenyl)butanoate CAS Name: (4R)-4-hydroxy-4-(2,3,4,5,6-pentamethylphenyl)butanoate IUPAC Name: (4R)-4-hydroxy-4-(2,3,4,5,6-pentamethylphenyl)butanoate Traditional Name: (4R)-4-hydroxy-4-(2,3,4,5,6-pentamethylphenyl)butyrate Formula: C15H21O3- MolecularWeight: 249.32544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)C(CCC(=O)[O-])O)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)[C@@H](CCC(=O)[O-])O)C)C

InChI

InChI=1S/C15H22O3/c1-8-9(2)11(4)15(12(5)10(8)3)13(16)6-7-14(17)18/h13,16H,6-7H2,1-5H3,(H,17,18)/p-1/t13-/m1/s1