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

Systemtic Name: hexan-2-yl 4-acetyloxy-3-ethyl-benzoate Openeye Name: 1-methylpentyl 4-acetoxy-3-ethyl-benzoate CAS Name: 4-acetyloxy-3-ethylbenzoic acid hexan-2-yl ester IUPAC Name: hexan-2-yl 4-acetyloxy-3-ethylbenzoate Traditional Name: 4-acetoxy-3-ethyl-benzoic acid 1-methylpentyl ester Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24O4/c1-5-7-8-12(3)20-17(19)15-9-10-16(21-13(4)18)14(6-2)11-15/h9-12H,5-8H2,1-4H3