ethyl 8-(4-chloranylphenoxy)-2-(hydroxymethyl)-2-oxidanyl-octanoate

Systemtic Name: ethyl 8-(4-chloranylphenoxy)-2-(hydroxymethyl)-2-oxidanyl-octanoate Openeye Name: ethyl 8-(4-chlorophenoxy)-2-hydroxy-2-(hydroxymethyl)octanoate CAS Name: 8-(4-chlorophenoxy)-2-hydroxy-2-(hydroxymethyl)octanoic acid ethyl ester IUPAC Name: ethyl 8-(4-chlorophenoxy)-2-hydroxy-2-(hydroxymethyl)octanoate Traditional Name: 8-(4-chlorophenoxy)-2-hydroxy-2-methylol-caprylic acid ethyl ester Formula: C17H25ClO5 MolecularWeight: 344.8304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCCOC1=CC=C(C=C1)Cl)(CO)O

Isomeric SMILES

CCOC(=O)C(CCCCCCOC1=CC=C(C=C1)Cl)(CO)O

InChI

InChI=1S/C17H25ClO5/c1-2-22-16(20)17(21,13-19)11-5-3-4-6-12-23-15-9-7-14(18)8-10-15/h7-10,19,21H,2-6,11-13H2,1H3