N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]octanamide

Systemtic Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]octanamide Openeye Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]octanamide CAS Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]octanamide IUPAC Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]octanamide Traditional Name: N-[4-[3-ethoxy-5-(3-fluorophenyl)-1,2,4-triazol-1-yl]phenyl]caprylamide Formula: C24H29FN4O2 MolecularWeight: 424.511063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OCC)C3=CC(=CC=C3)F

Isomeric SMILES

CCCCCCCC(=O)NC1=CC=C(C=C1)N2C(=NC(=N2)OCC)C3=CC(=CC=C3)F

InChI

InChI=1S/C24H29FN4O2/c1-3-5-6-7-8-12-22(30)26-20-13-15-21(16-14-20)29-23(27-24(28-29)31-4-2)18-10-9-11-19(25)17-18/h9-11,13-17H,3-8,12H2,1-2H3,(H,26,30)