(phenylmethyl) 7,7-dimethyloctanoate

Systemtic Name: (phenylmethyl) 7,7-dimethyloctanoate Openeye Name: benzyl 7,7-dimethyloctanoate CAS Name: 7,7-dimethyloctanoic acid (phenylmethyl) ester IUPAC Name: benzyl 7,7-dimethyloctanoate Traditional Name: 7,7-dimethylcaprylic acid benzyl ester Formula: C17H26O2 MolecularWeight: 262.38714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)CCCCCC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H26O2/c1-17(2,3)13-9-5-8-12-16(18)19-14-15-10-6-4-7-11-15/h4,6-7,10-11H,5,8-9,12-14H2,1-3H3