[6-[2-(4-fluorophenyl)ethyl]pyridin-3-yl] 4-pentylbenzoate

Systemtic Name: [6-[2-(4-fluorophenyl)ethyl]pyridin-3-yl] 4-pentylbenzoate Openeye Name: [6-[2-(4-fluorophenyl)ethyl]-3-pyridyl] 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid [6-[2-(4-fluorophenyl)ethyl]-3-pyridinyl] ester IUPAC Name: [6-[2-(4-fluorophenyl)ethyl]pyridin-3-yl] 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid [6-[2-(4-fluorophenyl)ethyl]-3-pyridyl] ester Formula: C25H26FNO2 MolecularWeight: 391.477843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)F

InChI

InChI=1S/C25H26FNO2/c1-2-3-4-5-19-6-11-21(12-7-19)25(28)29-24-17-16-23(27-18-24)15-10-20-8-13-22(26)14-9-20/h6-9,11-14,16-18H,2-5,10,15H2,1H3