(E)-7-(3-heptoxy-2-bicyclo[2.2.1]heptanyl)hept-2-enoic acid

Systemtic Name: (E)-7-(3-heptoxy-2-bicyclo[2.2.1]heptanyl)hept-2-enoic acid Openeye Name: (E)-7-(3-heptoxynorbornan-2-yl)hept-2-enoic acid CAS Name: (E)-7-(3-heptoxy-2-bicyclo[2.2.1]heptanyl)-2-heptenoic acid IUPAC Name: (E)-7-(3-heptoxy-2-bicyclo[2.2.1]heptanyl)hept-2-enoic acid Traditional Name: (E)-7-(3-heptoxynorbornan-2-yl)hept-2-enoic acid Formula: C21H36O3 MolecularWeight: 336.50874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1C2CCC(C2)C1CCCCC=CC(=O)O

Isomeric SMILES

CCCCCCCOC1C2CCC(C2)C1CCCC/C=C/C(=O)O

InChI

InChI=1S/C21H36O3/c1-2-3-4-7-10-15-24-21-18-14-13-17(16-18)19(21)11-8-5-6-9-12-20(22)23/h9,12,17-19,21H,2-8,10-11,13-16H2,1H3,(H,22,23)/b12-9+