1-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-4-ethyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-(2,3-dihydro-1,4-dioxin-5-ylcarbonylamino)-4-ethyl-cyclohexane-1-carboxylic acid Openeye Name: 1-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-4-ethyl-cyclohexanecarboxylic acid CAS Name: 1-[[2,3-dihydro-1,4-dioxin-5-yl(oxo)methyl]amino]-4-ethyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-(2,3-dihydro-1,4-dioxine-5-carbonylamino)-4-ethylcyclohexane-1-carboxylic acid Traditional Name: 1-(2,3-dihydro-p-dioxin-5-carbonylamino)-4-ethyl-cyclohexanecarboxylic acid Formula: C14H21NO5 MolecularWeight: 283.32024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)C2=COCCO2

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)C2=COCCO2

InChI

InChI=1S/C14H21NO5/c1-2-10-3-5-14(6-4-10,13(17)18)15-12(16)11-9-19-7-8-20-11/h9-10H,2-8H2,1H3,(H,15,16)(H,17,18)