6-hexyl-6-oxidanyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 6-hexyl-6-oxidanyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 6-hexyl-6-hydroxy-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 6-hexyl-6-hydroxy-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 6-hexyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 6-hexyl-6-hydroxy-cyclohexa-2,4-diene-1-carboxylic acid Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C=CC=CC1C(=O)O)O

Isomeric SMILES

CCCCCCC1(C=CC=CC1C(=O)O)O

InChI

InChI=1S/C13H20O3/c1-2-3-4-6-9-13(16)10-7-5-8-11(13)12(14)15/h5,7-8,10-11,16H,2-4,6,9H2,1H3,(H,14,15)