methyl 5-methyl-5-[4-oxidanyl-3-(phenylcarbonyl)phenyl]hexanoate

Systemtic Name: methyl 5-methyl-5-[4-oxidanyl-3-(phenylcarbonyl)phenyl]hexanoate Openeye Name: methyl 5-(3-benzoyl-4-hydroxy-phenyl)-5-methyl-hexanoate CAS Name: 5-(3-benzoyl-4-hydroxyphenyl)-5-methylhexanoic acid methyl ester IUPAC Name: methyl 5-(3-benzoyl-4-hydroxyphenyl)-5-methylhexanoate Traditional Name: 5-(3-benzoyl-4-hydroxy-phenyl)-5-methyl-hexanoic acid methyl ester Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(=O)OC)C1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)(CCCC(=O)OC)C1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H24O4/c1-21(2,13-7-10-19(23)25-3)16-11-12-18(22)17(14-16)20(24)15-8-5-4-6-9-15/h4-6,8-9,11-12,14,22H,7,10,13H2,1-3H3