4-[6-(2-hydroxyethyloxy)-5-methyl-6-oxidanylidene-hexan-3-yl]benzoate

Systemtic Name: 4-[6-(2-hydroxyethyloxy)-5-methyl-6-oxidanylidene-hexan-3-yl]benzoate Openeye Name: 4-[1-ethyl-4-(2-hydroxyethoxy)-3-methyl-4-oxo-butyl]benzoate CAS Name: 4-[6-(2-hydroxyethoxy)-5-methyl-6-oxohexan-3-yl]benzoate IUPAC Name: 4-[6-(2-hydroxyethoxy)-5-methyl-6-oxohexan-3-yl]benzoate Traditional Name: 4-[1-ethyl-4-(2-hydroxyethoxy)-4-keto-3-methyl-butyl]benzoate Formula: C16H21O5- MolecularWeight: 293.33494

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)OCCO)C1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CCC(CC(C)C(=O)OCCO)C1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C16H22O5/c1-3-12(10-11(2)16(20)21-9-8-17)13-4-6-14(7-5-13)15(18)19/h4-7,11-12,17H,3,8-10H2,1-2H3,(H,18,19)/p-1