octyl 4-methyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-triene-5-carboxylate

Systemtic Name: octyl 4-methyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-triene-5-carboxylate Openeye Name: octyl 4-methyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-triene-5-carboxylate CAS Name: 4-methyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-triene-5-carboxylic acid octyl ester IUPAC Name: octyl 4-methyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-triene-5-carboxylate Traditional Name: 4-methyl-7-oxabicyclo[4.1.0]hepta-1(6),2,4-triene-5-carboxylic acid octyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C(C=CC2=C1O2)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=C(C=CC2=C1O2)C

InChI

InChI=1S/C16H22O3/c1-3-4-5-6-7-8-11-18-16(17)14-12(2)9-10-13-15(14)19-13/h9-10H,3-8,11H2,1-2H3