(E,2R,3S)-2-[2,4-bis(fluoranyl)phenyl]-6-(3-fluorophenyl)-3-methyl-1-(1,2,4-triazol-1-yl)hex-5-en-2-ol

Systemtic Name: (E,2R,3S)-2-[2,4-bis(fluoranyl)phenyl]-6-(3-fluorophenyl)-3-methyl-1-(1,2,4-triazol-1-yl)hex-5-en-2-ol Openeye Name: (E,2R,3S)-2-(2,4-difluorophenyl)-6-(3-fluorophenyl)-3-methyl-1-(1,2,4-triazol-1-yl)hex-5-en-2-ol CAS Name: (E,2R,3S)-2-(2,4-difluorophenyl)-6-(3-fluorophenyl)-3-methyl-1-(1,2,4-triazol-1-yl)-5-hexen-2-ol IUPAC Name: (E,2R,3S)-2-(2,4-difluorophenyl)-6-(3-fluorophenyl)-3-methyl-1-(1,2,4-triazol-1-yl)hex-5-en-2-ol Traditional Name: (E,2R,3S)-2-(2,4-difluorophenyl)-6-(3-fluorophenyl)-3-methyl-1-(1,2,4-triazol-1-yl)hex-5-en-2-ol Formula: C21H20F3N3O MolecularWeight: 387.39821

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC1=CC(=CC=C1)F)C(CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O

Isomeric SMILES

C[C@@H](C/C=C/C1=CC(=CC=C1)F)[C@](CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O

InChI

InChI=1S/C21H20F3N3O/c1-15(4-2-5-16-6-3-7-17(22)10-16)21(28,12-27-14-25-13-26-27)19-9-8-18(23)11-20(19)24/h2-3,5-11,13-15,28H,4,12H2,1H3/b5-2+/t15-,21+/m0/s1