methyl 4-[3-[5-(2-methylpropanoyl)-2-oxidanyl-phenyl]propyl]benzoate

Systemtic Name: methyl 4-[3-[5-(2-methylpropanoyl)-2-oxidanyl-phenyl]propyl]benzoate Openeye Name: methyl 4-[3-[2-hydroxy-5-(2-methylpropanoyl)phenyl]propyl]benzoate CAS Name: 4-[3-[2-hydroxy-5-(2-methyl-1-oxopropyl)phenyl]propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[2-hydroxy-5-(2-methylpropanoyl)phenyl]propyl]benzoate Traditional Name: 4-[3-(2-hydroxy-5-isobutyryl-phenyl)propyl]benzoic acid methyl ester Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CC(=C(C=C1)O)CCCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)C(=O)C1=CC(=C(C=C1)O)CCCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H24O4/c1-14(2)20(23)18-11-12-19(22)17(13-18)6-4-5-15-7-9-16(10-8-15)21(24)25-3/h7-14,22H,4-6H2,1-3H3