3,5,5-trimethylhexyl 6-methylheptanoate

Systemtic Name: 3,5,5-trimethylhexyl 6-methylheptanoate Openeye Name: 3,5,5-trimethylhexyl 6-methylheptanoate CAS Name: 6-methylheptanoic acid 3,5,5-trimethylhexyl ester IUPAC Name: 3,5,5-trimethylhexyl 6-methylheptanoate Traditional Name: 6-methylenanthic acid 3,5,5-trimethylhexyl ester Formula: C17H34O2 MolecularWeight: 270.45066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCC(=O)OCCC(C)CC(C)(C)C

Isomeric SMILES

CC(C)CCCCC(=O)OCCC(C)CC(C)(C)C

InChI

InChI=1S/C17H34O2/c1-14(2)9-7-8-10-16(18)19-12-11-15(3)13-17(4,5)6/h14-15H,7-13H2,1-6H3