5-oxidanyloctan-2-yl benzoate

Systemtic Name: 5-oxidanyloctan-2-yl benzoate Openeye Name: (4-hydroxy-1-methyl-heptyl) benzoate CAS Name: benzoic acid 5-hydroxyoctan-2-yl ester IUPAC Name: 5-hydroxyoctan-2-yl benzoate Traditional Name: benzoic acid (4-hydroxy-1-methyl-heptyl) ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(C)OC(=O)C1=CC=CC=C1)O

Isomeric SMILES

CCCC(CCC(C)OC(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C15H22O3/c1-3-7-14(16)11-10-12(2)18-15(17)13-8-5-4-6-9-13/h4-6,8-9,12,14,16H,3,7,10-11H2,1-2H3