methyl 3-methyl-3-oxidanyl-5-phenyl-pentanoate

Systemtic Name: methyl 3-methyl-3-oxidanyl-5-phenyl-pentanoate Openeye Name: methyl 3-hydroxy-3-methyl-5-phenyl-pentanoate CAS Name: 3-hydroxy-3-methyl-5-phenylpentanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-3-methyl-5-phenylpentanoate Traditional Name: 3-hydroxy-3-methyl-5-phenyl-valeric acid methyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-13(15,10-12(14)16-2)9-8-11-6-4-3-5-7-11/h3-7,15H,8-10H2,1-2H3