8-(2-methyl-1,3-benzodioxol-2-yl)-5-oxidanyl-octanoic acid

Systemtic Name: 8-(2-methyl-1,3-benzodioxol-2-yl)-5-oxidanyl-octanoic acid Openeye Name: 5-hydroxy-8-(2-methyl-1,3-benzodioxol-2-yl)octanoic acid CAS Name: 5-hydroxy-8-(2-methyl-1,3-benzodioxol-2-yl)octanoic acid IUPAC Name: 5-hydroxy-8-(2-methyl-1,3-benzodioxol-2-yl)octanoic acid Traditional Name: 5-hydroxy-8-(2-methyl-1,3-benzodioxol-2-yl)caprylic acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=CC=CC=C2O1)CCCC(CCCC(=O)O)O

Isomeric SMILES

CC1(OC2=CC=CC=C2O1)CCCC(CCCC(=O)O)O

InChI

InChI=1S/C16H22O5/c1-16(20-13-8-2-3-9-14(13)21-16)11-5-7-12(17)6-4-10-15(18)19/h2-3,8-9,12,17H,4-7,10-11H2,1H3,(H,18,19)