1-butyl-2-oxidanyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 1-butyl-2-oxidanyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 1-butyl-2-hydroxy-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 1-butyl-2-hydroxy-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 1-butyl-2-hydroxycyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 1-butyl-2-hydroxy-cyclohexa-2,4-diene-1-carboxylic acid Formula: C11H16O3 MolecularWeight: 196.24294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC=CC=C1O)C(=O)O

Isomeric SMILES

CCCCC1(CC=CC=C1O)C(=O)O

InChI

InChI=1S/C11H16O3/c1-2-3-7-11(10(13)14)8-5-4-6-9(11)12/h4-6,12H,2-3,7-8H2,1H3,(H,13,14)