1-(1-hexoxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylic acid

Systemtic Name: 1-(1-hexoxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylic acid Openeye Name: 1-(1-hexoxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylic acid CAS Name: 1-(1-hexoxyethyl)-4-phenyl-1-cyclohexa-2,5-dienecarboxylic acid IUPAC Name: 1-(1-hexoxyethyl)-4-phenylcyclohexa-2,5-diene-1-carboxylic acid Traditional Name: 1-(1-hexoxyethyl)-4-phenyl-cyclohexa-2,5-diene-1-carboxylic acid Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(C)C1(C=CC(C=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCOC(C)C1(C=CC(C=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H28O3/c1-3-4-5-9-16-24-17(2)21(20(22)23)14-12-19(13-15-21)18-10-7-6-8-11-18/h6-8,10-15,17,19H,3-5,9,16H2,1-2H3,(H,22,23)