methyl 2-oxidanyl-6-(8-oxidanyloctyl)-4-phenylmethoxy-benzoate

Systemtic Name: methyl 2-oxidanyl-6-(8-oxidanyloctyl)-4-phenylmethoxy-benzoate Openeye Name: methyl 4-benzyloxy-2-hydroxy-6-(8-hydroxyoctyl)benzoate CAS Name: 2-hydroxy-6-(8-hydroxyoctyl)-4-phenylmethoxybenzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-6-(8-hydroxyoctyl)-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-2-hydroxy-6-(8-hydroxyoctyl)benzoic acid methyl ester Formula: C23H30O5 MolecularWeight: 386.4813

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1CCCCCCCCO)OCC2=CC=CC=C2)O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1CCCCCCCCO)OCC2=CC=CC=C2)O

InChI

InChI=1S/C23H30O5/c1-27-23(26)22-19(13-9-4-2-3-5-10-14-24)15-20(16-21(22)25)28-17-18-11-7-6-8-12-18/h6-8,11-12,15-16,24-25H,2-5,9-10,13-14,17H2,1H3