5-[2-[2-(hydroxymethyl)phenyl]ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid

Systemtic Name: 5-[2-[2-(hydroxymethyl)phenyl]ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid Openeye Name: 5-hydroxy-5-[2-[2-(hydroxymethyl)phenyl]ethyl]-6-methyl-3-oxo-heptanoic acid CAS Name: 5-hydroxy-5-[2-[2-(hydroxymethyl)phenyl]ethyl]-6-methyl-3-oxoheptanoic acid IUPAC Name: 5-hydroxy-5-[2-[2-(hydroxymethyl)phenyl]ethyl]-6-methyl-3-oxoheptanoic acid Traditional Name: 5-hydroxy-3-keto-6-methyl-5-[2-(2-methylolphenyl)ethyl]enanthic acid Formula: C17H24O5 MolecularWeight: 308.36946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC1=CC=CC=C1CO)(CC(=O)CC(=O)O)O

Isomeric SMILES

CC(C)C(CCC1=CC=CC=C1CO)(CC(=O)CC(=O)O)O

InChI

InChI=1S/C17H24O5/c1-12(2)17(22,10-15(19)9-16(20)21)8-7-13-5-3-4-6-14(13)11-18/h3-6,12,18,22H,7-11H2,1-2H3,(H,20,21)