2-oxidanyl-3-(4-oxidanylbutoxy)-4-oxidanylidene-4-phenylmethoxy-butanoate

Systemtic Name: 2-oxidanyl-3-(4-oxidanylbutoxy)-4-oxidanylidene-4-phenylmethoxy-butanoate Openeye Name: 4-benzyloxy-2-hydroxy-3-(4-hydroxybutoxy)-4-oxo-butanoate CAS Name: 2-hydroxy-3-(4-hydroxybutoxy)-4-oxo-4-phenylmethoxybutanoate IUPAC Name: 2-hydroxy-3-(4-hydroxybutoxy)-4-oxo-4-phenylmethoxybutanoate Traditional Name: 4-benzoxy-2-hydroxy-3-(4-hydroxybutoxy)-4-keto-butyrate Formula: C15H19O7- MolecularWeight: 311.30716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(C(C(=O)[O-])O)OCCCCO

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(C(C(=O)[O-])O)OCCCCO

InChI

InChI=1S/C15H20O7/c16-8-4-5-9-21-13(12(17)14(18)19)15(20)22-10-11-6-2-1-3-7-11/h1-3,6-7,12-13,16-17H,4-5,8-10H2,(H,18,19)/p-1