1-[5-(3-fluorophenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]tetradecan-1-one

Systemtic Name: 1-[5-(3-fluorophenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]tetradecan-1-one Openeye Name: 1-[5-(3-fluorophenyl)-3-isopropoxy-1,2,4-triazol-1-yl]tetradecan-1-one CAS Name: 1-[5-(3-fluorophenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-1-tetradecanone IUPAC Name: 1-[5-(3-fluorophenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]tetradecan-1-one Traditional Name: 1-[5-(3-fluorophenyl)-3-isopropoxy-1,2,4-triazol-1-yl]tetradecan-1-one Formula: C25H38FN3O2 MolecularWeight: 431.586523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)N1C(=NC(=N1)OC(C)C)C2=CC(=CC=C2)F

Isomeric SMILES

CCCCCCCCCCCCCC(=O)N1C(=NC(=N1)OC(C)C)C2=CC(=CC=C2)F

InChI

InChI=1S/C25H38FN3O2/c1-4-5-6-7-8-9-10-11-12-13-14-18-23(30)29-24(21-16-15-17-22(26)19-21)27-25(28-29)31-20(2)3/h15-17,19-20H,4-14,18H2,1-3H3