phenyl 2-(2-methylpropyl)octadecanoate

Systemtic Name: phenyl 2-(2-methylpropyl)octadecanoate Openeye Name: phenyl 2-isobutyloctadecanoate CAS Name: 2-(2-methylpropyl)octadecanoic acid phenyl ester IUPAC Name: phenyl 2-(2-methylpropyl)octadecanoate Traditional Name: 2-isobutylstearic acid phenyl ester Formula: C28H48O2 MolecularWeight: 416.67952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(C)C)C(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(C)C)C(=O)OC1=CC=CC=C1

InChI

InChI=1S/C28H48O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-26(24-25(2)3)28(29)30-27-22-19-17-20-23-27/h17,19-20,22-23,25-26H,4-16,18,21,24H2,1-3H3