methyl 3-[2-[1,6-bis(oxidanyl)hexyl]-6-methoxy-phenyl]propanoate

Systemtic Name: methyl 3-[2-[1,6-bis(oxidanyl)hexyl]-6-methoxy-phenyl]propanoate Openeye Name: methyl 3-[2-(1,6-dihydroxyhexyl)-6-methoxy-phenyl]propanoate CAS Name: 3-[2-(1,6-dihydroxyhexyl)-6-methoxyphenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(1,6-dihydroxyhexyl)-6-methoxyphenyl]propanoate Traditional Name: 3-[2-(1,6-dihydroxyhexyl)-6-methoxy-phenyl]propionic acid methyl ester Formula: C17H26O5 MolecularWeight: 310.38534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1CCC(=O)OC)C(CCCCCO)O

Isomeric SMILES

COC1=CC=CC(=C1CCC(=O)OC)C(CCCCCO)O

InChI

InChI=1S/C17H26O5/c1-21-16-9-6-7-13(14(16)10-11-17(20)22-2)15(19)8-4-3-5-12-18/h6-7,9,15,18-19H,3-5,8,10-12H2,1-2H3