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octan-3-yl 3,5-dimethylbenzoate

octan-3-yl 3,5-dimethylbenzoate

Systemtic Name:octan-3-yl 3,5-dimethylbenzoate
Openeye Name:1-ethylhexyl 3,5-dimethylbenzoate
CAS Name:3,5-dimethylbenzoic acid octan-3-yl ester
IUPAC Name:octan-3-yl 3,5-dimethylbenzoate
Traditional Name:3,5-dimethylbenzoic acid 1-ethylhexyl ester
Formula: C17H26O2
MolecularWeight: 262.38714
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C17H26O2/c1-5-7-8-9-16(6-2)19-17(18)15-11-13(3)10-14(4)12-15/h10-12,16H,5-9H2,1-4H3


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