pentyl 6-oxidanylcyclohexa-1,3-diene-1-carboxylate

Systemtic Name: pentyl 6-oxidanylcyclohexa-1,3-diene-1-carboxylate Openeye Name: pentyl 6-hydroxycyclohexa-1,3-diene-1-carboxylate CAS Name: 6-hydroxy-1-cyclohexa-1,3-dienecarboxylic acid pentyl ester IUPAC Name: pentyl 6-hydroxycyclohexa-1,3-diene-1-carboxylate Traditional Name: 6-hydroxycyclohexa-1,3-diene-1-carboxylic acid amyl ester Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=CCC1O

Isomeric SMILES

CCCCCOC(=O)C1=CC=CCC1O

InChI

InChI=1S/C12H18O3/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7,11,13H,2-3,6,8-9H2,1H3