4-butyl-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylic acid

Systemtic Name: 4-butyl-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylic acid Openeye Name: 4-butyl-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylic acid CAS Name: 4-butyl-4-(2-pentylphenyl)-1-cyclohexa-2,5-dienecarboxylic acid IUPAC Name: 4-butyl-4-(2-pentylphenyl)cyclohexa-2,5-diene-1-carboxylic acid Traditional Name: 4-(2-amylphenyl)-4-butyl-cyclohexa-2,5-diene-1-carboxylic acid Formula: C22H30O2 MolecularWeight: 326.4724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1C2(C=CC(C=C2)C(=O)O)CCCC

Isomeric SMILES

CCCCCC1=CC=CC=C1C2(C=CC(C=C2)C(=O)O)CCCC

InChI

InChI=1S/C22H30O2/c1-3-5-7-10-18-11-8-9-12-20(18)22(15-6-4-2)16-13-19(14-17-22)21(23)24/h8-9,11-14,16-17,19H,3-7,10,15H2,1-2H3,(H,23,24)