butyl 2-tert-butyl-2-ethyl-hexanoate

Systemtic Name: butyl 2-tert-butyl-2-ethyl-hexanoate Openeye Name: butyl 2-tert-butyl-2-ethyl-hexanoate CAS Name: 2-tert-butyl-2-ethylhexanoic acid butyl ester IUPAC Name: butyl 2-tert-butyl-2-ethylhexanoate Traditional Name: 2-tert-butyl-2-ethyl-hexanoic acid butyl ester Formula: C16H32O2 MolecularWeight: 256.42408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(C(=O)OCCCC)C(C)(C)C

Isomeric SMILES

CCCCC(CC)(C(=O)OCCCC)C(C)(C)C

InChI

InChI=1S/C16H32O2/c1-7-10-12-16(9-3,15(4,5)6)14(17)18-13-11-8-2/h7-13H2,1-6H3