2-methylpropyl 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate

Systemtic Name: 2-methylpropyl 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate Openeye Name: isobutyl 5-(2,5-dimethylphenoxy)-2,2-dimethyl-pentanoate CAS Name: 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoate Traditional Name: 5-(2,5-dimethylphenoxy)-2,2-dimethyl-valeric acid isobutyl ester Formula: C19H30O3 MolecularWeight: 306.4397

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O3/c1-14(2)13-22-18(20)19(5,6)10-7-11-21-17-12-15(3)8-9-16(17)4/h8-9,12,14H,7,10-11,13H2,1-6H3