2-pyridin-2-ylethyl 2-fluoranyl-4-(4-heptylphenyl)benzoate

Systemtic Name: 2-pyridin-2-ylethyl 2-fluoranyl-4-(4-heptylphenyl)benzoate Openeye Name: 2-(2-pyridyl)ethyl 2-fluoro-4-(4-heptylphenyl)benzoate CAS Name: 2-fluoro-4-(4-heptylphenyl)benzoic acid 2-(2-pyridinyl)ethyl ester IUPAC Name: 2-pyridin-2-ylethyl 2-fluoro-4-(4-heptylphenyl)benzoate Traditional Name: 2-fluoro-4-(4-heptylphenyl)benzoic acid 2-(2-pyridyl)ethyl ester Formula: C27H30FNO2 MolecularWeight: 419.531003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OCCC3=CC=CC=N3)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OCCC3=CC=CC=N3)F

InChI

InChI=1S/C27H30FNO2/c1-2-3-4-5-6-9-21-11-13-22(14-12-21)23-15-16-25(26(28)20-23)27(30)31-19-17-24-10-7-8-18-29-24/h7-8,10-16,18,20H,2-6,9,17,19H2,1H3