(2S)-3,3-dimethyl-2-(2-oxidanylidene-2-phenylmethoxy-ethyl)butanoic acid

Systemtic Name: (2S)-3,3-dimethyl-2-(2-oxidanylidene-2-phenylmethoxy-ethyl)butanoic acid Openeye Name: (2S)-2-(2-benzyloxy-2-oxo-ethyl)-3,3-dimethyl-butanoic acid CAS Name: (2S)-3,3-dimethyl-2-(2-oxo-2-phenylmethoxyethyl)butanoic acid IUPAC Name: (2S)-3,3-dimethyl-2-(2-oxo-2-phenylmethoxyethyl)butanoic acid Traditional Name: (2S)-2-(2-benzoxy-2-keto-ethyl)-3,3-dimethyl-butyric acid Formula: C15H20O4 MolecularWeight: 264.3169

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(C)[C@H](CC(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C15H20O4/c1-15(2,3)12(14(17)18)9-13(16)19-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,18)/t12-/m1/s1