1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptane-1-carboxylic acid

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptane-1-carboxylic acid Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptanecarboxylic acid CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-cycloheptanecarboxylic acid IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptane-1-carboxylic acid Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)cycloheptanecarboxylic acid Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C2=CC3=C(C=C2)OCCO3)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(C2=CC3=C(C=C2)OCCO3)C(=O)O

InChI

InChI=1S/C16H20O4/c17-15(18)16(7-3-1-2-4-8-16)12-5-6-13-14(11-12)20-10-9-19-13/h5-6,11H,1-4,7-10H2,(H,17,18)