3-(4-methylpentoxymethyl)benzoate

Systemtic Name: 3-(4-methylpentoxymethyl)benzoate Openeye Name: 3-(isohexyloxymethyl)benzoate CAS Name: 3-(4-methylpentoxymethyl)benzoate IUPAC Name: 3-(4-methylpentoxymethyl)benzoate Traditional Name: 3-(isohexyloxymethyl)benzoate Formula: C14H19O3- MolecularWeight: 235.29886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOCC1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

CC(C)CCCOCC1=CC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C14H20O3/c1-11(2)5-4-8-17-10-12-6-3-7-13(9-12)14(15)16/h3,6-7,9,11H,4-5,8,10H2,1-2H3,(H,15,16)/p-1