(2S)-2-methyl-4-oxidanylidene-4-phenylmethoxy-butanoic acid

Systemtic Name: (2S)-2-methyl-4-oxidanylidene-4-phenylmethoxy-butanoic acid Openeye Name: (2S)-4-benzyloxy-2-methyl-4-oxo-butanoic acid CAS Name: (2S)-2-methyl-4-oxo-4-phenylmethoxybutanoic acid IUPAC Name: (2S)-2-methyl-4-oxo-4-phenylmethoxybutanoic acid Traditional Name: (2S)-4-benzoxy-4-keto-2-methyl-butyric acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O4/c1-9(12(14)15)7-11(13)16-8-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,14,15)/t9-/m0/s1