(4-pentylcyclohexyl) 4-(5-pentyloxan-2-yl)benzoate

Systemtic Name: (4-pentylcyclohexyl) 4-(5-pentyloxan-2-yl)benzoate Openeye Name: (4-pentylcyclohexyl) 4-(5-pentyltetrahydropyran-2-yl)benzoate CAS Name: 4-(5-pentyl-2-oxanyl)benzoic acid (4-pentylcyclohexyl) ester IUPAC Name: (4-pentylcyclohexyl) 4-(5-pentyloxan-2-yl)benzoate Traditional Name: 4-(5-amyltetrahydropyran-2-yl)benzoic acid (4-amylcyclohexyl) ester Formula: C28H44O3 MolecularWeight: 428.64716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3CCC(CO3)CCCCC

Isomeric SMILES

CCCCCC1CCC(CC1)OC(=O)C2=CC=C(C=C2)C3CCC(CO3)CCCCC

InChI

InChI=1S/C28H44O3/c1-3-5-7-9-22-11-18-26(19-12-22)31-28(29)25-16-14-24(15-17-25)27-20-13-23(21-30-27)10-8-6-4-2/h14-17,22-23,26-27H,3-13,18-21H2,1-2H3