tert-butyl 3-ethylheptanoate

Systemtic Name: tert-butyl 3-ethylheptanoate Openeye Name: tert-butyl 3-ethylheptanoate CAS Name: 3-ethylheptanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-ethylheptanoate Traditional Name: 3-ethylenanthic acid tert-butyl ester Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(CC)CC(=O)OC(C)(C)C

InChI

InChI=1S/C13H26O2/c1-6-8-9-11(7-2)10-12(14)15-13(3,4)5/h11H,6-10H2,1-5H3