3-oxidanylidene-2-[1-oxidanyl-2-oxidanylidene-2-(4-pentylphenyl)ethyl]hexanoate

Systemtic Name: 3-oxidanylidene-2-[1-oxidanyl-2-oxidanylidene-2-(4-pentylphenyl)ethyl]hexanoate Openeye Name: 2-[1-hydroxy-2-oxo-2-(4-pentylphenyl)ethyl]-3-oxo-hexanoate CAS Name: 2-[1-hydroxy-2-oxo-2-(4-pentylphenyl)ethyl]-3-oxohexanoate IUPAC Name: 2-[1-hydroxy-2-oxo-2-(4-pentylphenyl)ethyl]-3-oxohexanoate Traditional Name: 2-[2-(4-amylphenyl)-1-hydroxy-2-keto-ethyl]-3-keto-hexanoate Formula: C19H25O5- MolecularWeight: 333.3988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)C(C(C(=O)CCC)C(=O)[O-])O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)C(C(C(=O)CCC)C(=O)[O-])O

InChI

InChI=1S/C19H26O5/c1-3-5-6-8-13-9-11-14(12-10-13)17(21)18(22)16(19(23)24)15(20)7-4-2/h9-12,16,18,22H,3-8H2,1-2H3,(H,23,24)/p-1