(4-nonoxyphenyl) 4-heptylcyclohexane-1-carboxylate

Systemtic Name: (4-nonoxyphenyl) 4-heptylcyclohexane-1-carboxylate Openeye Name: (4-nonoxyphenyl) 4-heptylcyclohexanecarboxylate CAS Name: 4-heptyl-1-cyclohexanecarboxylic acid (4-nonoxyphenyl) ester IUPAC Name: (4-nonoxyphenyl) 4-heptylcyclohexane-1-carboxylate Traditional Name: 4-heptylcyclohexanecarboxylic acid (4-nonoxyphenyl) ester Formula: C29H48O3 MolecularWeight: 444.68962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2CCC(CC2)CCCCCCC

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2CCC(CC2)CCCCCCC

InChI

InChI=1S/C29H48O3/c1-3-5-7-9-10-12-14-24-31-27-20-22-28(23-21-27)32-29(30)26-18-16-25(17-19-26)15-13-11-8-6-4-2/h20-23,25-26H,3-19,24H2,1-2H3