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4-methylpentyl 2-ethylbenzoate

4-methylpentyl 2-ethylbenzoate

Systemtic Name:4-methylpentyl 2-ethylbenzoate
Openeye Name:isohexyl 2-ethylbenzoate
CAS Name:2-ethylbenzoic acid 4-methylpentyl ester
IUPAC Name:4-methylpentyl 2-ethylbenzoate
Traditional Name:2-ethylbenzoic acid isohexyl ester
Formula: C15H22O2
MolecularWeight: 234.33398
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C(=O)OCCCC(C)C


Isomeric SMILES

CCC1=CC=CC=C1C(=O)OCCCC(C)C


InChI

InChI=1S/C15H22O2/c1-4-13-9-5-6-10-14(13)15(16)17-11-7-8-12(2)3/h5-6,9-10,12H,4,7-8,11H2,1-3H3


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