methyl (3S)-2,2-dimethyl-3-oxidanyl-5-phenyl-pentanoate

Systemtic Name: methyl (3S)-2,2-dimethyl-3-oxidanyl-5-phenyl-pentanoate Openeye Name: methyl (3S)-3-hydroxy-2,2-dimethyl-5-phenyl-pentanoate CAS Name: (3S)-3-hydroxy-2,2-dimethyl-5-phenylpentanoic acid methyl ester IUPAC Name: methyl (3S)-3-hydroxy-2,2-dimethyl-5-phenylpentanoate Traditional Name: (3S)-3-hydroxy-2,2-dimethyl-5-phenyl-valeric acid methyl ester Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CCC1=CC=CC=C1)O)C(=O)OC

Isomeric SMILES

CC(C)([C@H](CCC1=CC=CC=C1)O)C(=O)OC

InChI

InChI=1S/C14H20O3/c1-14(2,13(16)17-3)12(15)10-9-11-7-5-4-6-8-11/h4-8,12,15H,9-10H2,1-3H3/t12-/m0/s1