(2S,4S)-2,4-dimethyl-5-phenylmethoxy-pentanoic acid

Systemtic Name: (2S,4S)-2,4-dimethyl-5-phenylmethoxy-pentanoic acid Openeye Name: (2S,4S)-5-benzyloxy-2,4-dimethyl-pentanoic acid CAS Name: (2S,4S)-2,4-dimethyl-5-phenylmethoxypentanoic acid IUPAC Name: (2S,4S)-2,4-dimethyl-5-phenylmethoxypentanoic acid Traditional Name: (2S,4S)-5-benzoxy-2,4-dimethyl-valeric acid Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)C(=O)O)COCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C[C@H](C)C(=O)O)COCC1=CC=CC=C1

InChI

InChI=1S/C14H20O3/c1-11(8-12(2)14(15)16)9-17-10-13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3,(H,15,16)/t11-,12-/m0/s1