4-(2-heptylphenyl)-4-pentyl-cyclohexane-1-carboxylic acid

Systemtic Name: 4-(2-heptylphenyl)-4-pentyl-cyclohexane-1-carboxylic acid Openeye Name: 4-(2-heptylphenyl)-4-pentyl-cyclohexanecarboxylic acid CAS Name: 4-(2-heptylphenyl)-4-pentyl-1-cyclohexanecarboxylic acid IUPAC Name: 4-(2-heptylphenyl)-4-pentylcyclohexane-1-carboxylic acid Traditional Name: 4-amyl-4-(2-heptylphenyl)cyclohexanecarboxylic acid Formula: C25H40O2 MolecularWeight: 372.5839

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=CC=C1C2(CCC(CC2)C(=O)O)CCCCC

Isomeric SMILES

CCCCCCCC1=CC=CC=C1C2(CCC(CC2)C(=O)O)CCCCC

InChI

InChI=1S/C25H40O2/c1-3-5-7-8-9-13-21-14-10-11-15-23(21)25(18-12-6-4-2)19-16-22(17-20-25)24(26)27/h10-11,14-15,22H,3-9,12-13,16-20H2,1-2H3,(H,26,27)