ethyl 3-tert-butyl-4,4-dimethyl-pentanoate

Systemtic Name: ethyl 3-tert-butyl-4,4-dimethyl-pentanoate Openeye Name: ethyl 3-tert-butyl-4,4-dimethyl-pentanoate CAS Name: 3-tert-butyl-4,4-dimethylpentanoic acid ethyl ester IUPAC Name: ethyl 3-tert-butyl-4,4-dimethylpentanoate Traditional Name: 3-tert-butyl-4,4-dimethyl-valeric acid ethyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCOC(=O)CC(C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C13H26O2/c1-8-15-11(14)9-10(12(2,3)4)13(5,6)7/h10H,8-9H2,1-7H3