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

Systemtic Name: 2-methylpropyl 7-oxidanylidene-7-(2,4,6-trimethylphenyl)heptanoate Openeye Name: isobutyl 7-oxo-7-(2,4,6-trimethylphenyl)heptanoate CAS Name: 7-oxo-7-(2,4,6-trimethylphenyl)heptanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 7-oxo-7-(2,4,6-trimethylphenyl)heptanoate Traditional Name: 7-keto-7-mesityl-enanthic acid isobutyl ester Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)CCCCCC(=O)OCC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)CCCCCC(=O)OCC(C)C)C

InChI

InChI=1S/C20H30O3/c1-14(2)13-23-19(22)10-8-6-7-9-18(21)20-16(4)11-15(3)12-17(20)5/h11-12,14H,6-10,13H2,1-5H3