2-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methyl]cyclohexanecarboxylic acid CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methyl]cyclohexanecarboxylic acid Formula: C16H20O5 MolecularWeight: 292.327

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(C2=CC3=C(C=C2)OCCO3)O)C(=O)O

Isomeric SMILES

C1CCC(C(C1)C(C2=CC3=C(C=C2)OCCO3)O)C(=O)O

InChI

InChI=1S/C16H20O5/c17-15(11-3-1-2-4-12(11)16(18)19)10-5-6-13-14(9-10)21-8-7-20-13/h5-6,9,11-12,15,17H,1-4,7-8H2,(H,18,19)