hexan-2-yl 3-ethyl-4-oxidanyl-benzoate

Systemtic Name: hexan-2-yl 3-ethyl-4-oxidanyl-benzoate Openeye Name: 1-methylpentyl 3-ethyl-4-hydroxy-benzoate CAS Name: 3-ethyl-4-hydroxybenzoic acid hexan-2-yl ester IUPAC Name: hexan-2-yl 3-ethyl-4-hydroxybenzoate Traditional Name: 3-ethyl-4-hydroxy-benzoic acid 1-methylpentyl ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O3/c1-4-6-7-11(3)18-15(17)13-8-9-14(16)12(5-2)10-13/h8-11,16H,4-7H2,1-3H3