7-cyclopentylheptyl 4-(5-octylpyridin-2-yl)benzoate

Systemtic Name: 7-cyclopentylheptyl 4-(5-octylpyridin-2-yl)benzoate Openeye Name: 7-cyclopentylheptyl 4-(5-octyl-2-pyridyl)benzoate CAS Name: 4-(5-octyl-2-pyridinyl)benzoic acid 7-cyclopentylheptyl ester IUPAC Name: 7-cyclopentylheptyl 4-(5-octylpyridin-2-yl)benzoate Traditional Name: 4-(5-octyl-2-pyridyl)benzoic acid 7-cyclopentylheptyl ester Formula: C32H47NO2 MolecularWeight: 477.72108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCCCCCC3CCCC3

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)OCCCCCCCC3CCCC3

InChI

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