(3S)-5-(4-tert-butylphenyl)-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-5-(4-tert-butylphenyl)-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: (3S)-5-(4-tert-butylphenyl)-3-methyl-5-oxo-pentanoic acid CAS Name: (3S)-5-(4-tert-butylphenyl)-3-methyl-5-oxopentanoic acid IUPAC Name: (3S)-5-(4-tert-butylphenyl)-3-methyl-5-oxopentanoic acid Traditional Name: (3S)-5-(4-tert-butylphenyl)-5-keto-3-methyl-valeric acid Formula: C16H22O3 MolecularWeight: 262.34408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=C(C=C1)C(C)(C)C)CC(=O)O

Isomeric SMILES

C[C@@H](CC(=O)C1=CC=C(C=C1)C(C)(C)C)CC(=O)O

InChI

InChI=1S/C16H22O3/c1-11(10-15(18)19)9-14(17)12-5-7-13(8-6-12)16(2,3)4/h5-8,11H,9-10H2,1-4H3,(H,18,19)/t11-/m0/s1