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

Systemtic Name: 1-[5-(3-fluorophenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Openeye Name: 1-[5-(3-fluorophenyl)-3-isopropoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one CAS Name: 1-[5-(3-fluorophenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-1-hexanone IUPAC Name: 1-[5-(3-fluorophenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-3,5,5-trimethylhexan-1-one Traditional Name: 1-[5-(3-fluorophenyl)-3-isopropoxy-1,2,4-triazol-1-yl]-3,5,5-trimethyl-hexan-1-one Formula: C20H28FN3O2 MolecularWeight: 361.453623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NN(C(=N1)C2=CC(=CC=C2)F)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CC(C)OC1=NN(C(=N1)C2=CC(=CC=C2)F)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C20H28FN3O2/c1-13(2)26-19-22-18(15-8-7-9-16(21)11-15)24(23-19)17(25)10-14(3)12-20(4,5)6/h7-9,11,13-14H,10,12H2,1-6H3