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

Systemtic Name: [6-[2-(4-fluorophenyl)ethyl]pyridin-3-yl] 4-heptoxybenzoate Openeye Name: [6-[2-(4-fluorophenyl)ethyl]-3-pyridyl] 4-heptoxybenzoate CAS Name: 4-heptoxybenzoic acid [6-[2-(4-fluorophenyl)ethyl]-3-pyridinyl] ester IUPAC Name: [6-[2-(4-fluorophenyl)ethyl]pyridin-3-yl] 4-heptoxybenzoate Traditional Name: 4-heptoxybenzoic acid [6-[2-(4-fluorophenyl)ethyl]-3-pyridyl] ester Formula: C27H30FNO3 MolecularWeight: 435.530403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)F

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CN=C(C=C2)CCC3=CC=C(C=C3)F

InChI

InChI=1S/C27H30FNO3/c1-2-3-4-5-6-19-31-25-16-10-22(11-17-25)27(30)32-26-18-15-24(29-20-26)14-9-21-7-12-23(28)13-8-21/h7-8,10-13,15-18,20H,2-6,9,14,19H2,1H3