(phenylmethyl) 7-oxidanylidene-7-(2,4,6-trimethylphenyl)heptanoate

Systemtic Name: (phenylmethyl) 7-oxidanylidene-7-(2,4,6-trimethylphenyl)heptanoate Openeye Name: benzyl 7-oxo-7-(2,4,6-trimethylphenyl)heptanoate CAS Name: 7-oxo-7-(2,4,6-trimethylphenyl)heptanoic acid (phenylmethyl) ester IUPAC Name: benzyl 7-oxo-7-(2,4,6-trimethylphenyl)heptanoate Traditional Name: 7-keto-7-mesityl-enanthic acid benzyl ester Formula: C23H28O3 MolecularWeight: 352.46662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)CCCCCC(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)CCCCCC(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C23H28O3/c1-17-14-18(2)23(19(3)15-17)21(24)12-8-5-9-13-22(25)26-16-20-10-6-4-7-11-20/h4,6-7,10-11,14-15H,5,8-9,12-13,16H2,1-3H3