2-methylpropyl 3-dodecylheptadecanoate

Systemtic Name: 2-methylpropyl 3-dodecylheptadecanoate Openeye Name: isobutyl 3-dodecylheptadecanoate CAS Name: 3-dodecylheptadecanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-dodecylheptadecanoate Traditional Name: 3-laurylheptadecanoic acid isobutyl ester Formula: C33H66O2 MolecularWeight: 494.87594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CCCCCCCCCCCC)CC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCC(CCCCCCCCCCCC)CC(=O)OCC(C)C

InChI

InChI=1S/C33H66O2/c1-5-7-9-11-13-15-17-18-20-22-24-26-28-32(29-33(34)35-30-31(3)4)27-25-23-21-19-16-14-12-10-8-6-2/h31-32H,5-30H2,1-4H3