(2S)-2-methyl-2-oxidanyl-6-phenylmethoxy-hexanoic acid

Systemtic Name: (2S)-2-methyl-2-oxidanyl-6-phenylmethoxy-hexanoic acid Openeye Name: (2S)-6-benzyloxy-2-hydroxy-2-methyl-hexanoic acid CAS Name: (2S)-2-hydroxy-2-methyl-6-phenylmethoxyhexanoic acid IUPAC Name: (2S)-2-hydroxy-2-methyl-6-phenylmethoxyhexanoic acid Traditional Name: (2S)-6-benzoxy-2-hydroxy-2-methyl-hexanoic acid Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCOCC1=CC=CC=C1)(C(=O)O)O

Isomeric SMILES

C[C@](CCCCOCC1=CC=CC=C1)(C(=O)O)O

InChI

InChI=1S/C14H20O4/c1-14(17,13(15)16)9-5-6-10-18-11-12-7-3-2-4-8-12/h2-4,7-8,17H,5-6,9-11H2,1H3,(H,15,16)/t14-/m0/s1