pentyl 4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carboxylate

Systemtic Name: pentyl 4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carboxylate Openeye Name: pentyl 4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarboxylate CAS Name: 4-(1-heptyl-4-bicyclo[2.2.2]octanyl)-1-cyclohexanecarboxylic acid pentyl ester IUPAC Name: pentyl 4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carboxylate Traditional Name: 4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarboxylic acid amyl ester Formula: C27H48O2 MolecularWeight: 404.66882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC12CCC(CC1)(CC2)C3CCC(CC3)C(=O)OCCCCC

Isomeric SMILES

CCCCCCCC12CCC(CC1)(CC2)C3CCC(CC3)C(=O)OCCCCC

InChI

InChI=1S/C27H48O2/c1-3-5-7-8-9-15-26-16-19-27(20-17-26,21-18-26)24-13-11-23(12-14-24)25(28)29-22-10-6-4-2/h23-24H,3-22H2,1-2H3