dodecyl 7-oxabicyclo[2.2.1]hepta-1,3,5-triene-3-carboxylate; 4-ethoxy-2-oxidanyl-benzoic acid

Systemtic Name: dodecyl 7-oxabicyclo[2.2.1]hepta-1,3,5-triene-3-carboxylate; 4-ethoxy-2-oxidanyl-benzoic acid Openeye Name: dodecyl 7-oxabicyclo[2.2.1]hepta-1,3,5-triene-3-carboxylate; 4-ethoxy-2-hydroxy-benzoic acid CAS Name: 4-ethoxy-2-hydroxybenzoic acid; 7-oxabicyclo[2.2.1]hepta-1,3,5-triene-3-carboxylic acid dodecyl ester IUPAC Name: dodecyl 7-oxabicyclo[2.2.1]hepta-1,3,5-triene-3-carboxylate; 4-ethoxy-2-hydroxybenzoic acid Traditional Name: 4-ethoxy-2-hydroxy-benzoic acid; 7-oxabicyclo[2.2.1]hepta-1,3,5-triene-3-carboxylic acid lauryl ester Formula: C28H38O7 MolecularWeight: 486.59712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=C2C=CC(=C1)O2.CCOC1=CC(=C(C=C1)C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=C2C=CC(=C1)O2.CCOC1=CC(=C(C=C1)C(=O)O)O

InChI

InChI=1S/C19H28O3.C9H10O4/c1-2-3-4-5-6-7-8-9-10-11-14-21-19(20)17-15-16-12-13-18(17)22-16;1-2-13-6-3-4-7(9(11)12)8(10)5-6/h12-13,15H,2-11,14H2,1H3;3-5,10H,2H2,1H3,(H,11,12)