(2R,3R)-2-[2,4-bis(fluoranyl)phenyl]-3-[[2-[(1E,3E)-4-(4-chlorophenyl)buta-1,3-dienyl]-1,3-dioxan-5-yl]phosphanyl]-1-(1,2,4-triazol-1-yl)butan-2-ol

Systemtic Name: (2R,3R)-2-[2,4-bis(fluoranyl)phenyl]-3-[[2-[(1E,3E)-4-(4-chlorophenyl)buta-1,3-dienyl]-1,3-dioxan-5-yl]phosphanyl]-1-(1,2,4-triazol-1-yl)butan-2-ol Openeye Name: (2R,3R)-3-[[2-[(1E,3E)-4-(4-chlorophenyl)buta-1,3-dienyl]-1,3-dioxan-5-yl]phosphanyl]-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)butan-2-ol CAS Name: (2R,3R)-3-[[2-[(1E,3E)-4-(4-chlorophenyl)buta-1,3-dienyl]-1,3-dioxan-5-yl]phosphino]-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)-2-butanol IUPAC Name: (2R,3R)-3-[[2-[(1E,3E)-4-(4-chlorophenyl)buta-1,3-dienyl]-1,3-dioxan-5-yl]phosphanyl]-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)butan-2-ol Traditional Name: (2R,3R)-3-[[2-[(1E,3E)-4-(4-chlorophenyl)buta-1,3-dienyl]-1,3-dioxan-5-yl]phosphino]-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)butan-2-ol Formula: C26H27ClF2N3O3P MolecularWeight: 533.934447

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)PC3COC(OC3)C=CC=CC4=CC=C(C=C4)Cl

Isomeric SMILES

C[C@H]([C@](CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)PC3COC(OC3)/C=C/C=C/C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H27ClF2N3O3P/c1-18(26(33,15-32-17-30-16-31-32)23-11-10-21(28)12-24(23)29)36-22-13-34-25(35-14-22)5-3-2-4-19-6-8-20(27)9-7-19/h2-12,16-18,22,25,33,36H,13-15H2,1H3/b4-2+,5-3+/t18-,22?,25?,26-,36?/m1/s1