hexyl 2-cyclopentyl-4-(5-nonylpyridin-2-yl)benzoate

Systemtic Name: hexyl 2-cyclopentyl-4-(5-nonylpyridin-2-yl)benzoate Openeye Name: hexyl 2-cyclopentyl-4-(5-nonyl-2-pyridyl)benzoate CAS Name: 2-cyclopentyl-4-(5-nonyl-2-pyridinyl)benzoic acid hexyl ester IUPAC Name: hexyl 2-cyclopentyl-4-(5-nonylpyridin-2-yl)benzoate Traditional Name: 2-cyclopentyl-4-(5-nonyl-2-pyridyl)benzoic acid hexyl ester Formula: C32H47NO2 MolecularWeight: 477.72108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)C(=O)OCCCCCC)C3CCCC3

Isomeric SMILES

CCCCCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)C(=O)OCCCCCC)C3CCCC3

InChI

InChI=1S/C32H47NO2/c1-3-5-7-9-10-11-12-16-26-19-22-31(33-25-26)28-20-21-29(30(24-28)27-17-13-14-18-27)32(34)35-23-15-8-6-4-2/h19-22,24-25,27H,3-18,23H2,1-2H3