2-[2,4-bis(fluoranyl)phenyl]-1-[4-[3-(4-phenylmethoxyphenoxy)propyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-2-ol

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-1-[4-[3-(4-phenylmethoxyphenoxy)propyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-2-ol Openeye Name: 1-[4-[3-(4-benzyloxyphenoxy)propyl]piperazin-1-yl]-2-(2,4-difluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol CAS Name: 2-(2,4-difluorophenyl)-1-[4-[3-(4-phenylmethoxyphenoxy)propyl]-1-piperazinyl]-3-(1,2,4-triazol-1-yl)-2-propanol IUPAC Name: 2-(2,4-difluorophenyl)-1-[4-[3-(4-phenylmethoxyphenoxy)propyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-2-ol Traditional Name: 1-[4-[3-(4-benzoxyphenoxy)propyl]piperazino]-2-(2,4-difluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol Formula: C31H35F2N5O3 MolecularWeight: 563.638106

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=C(C=C2)OCC3=CC=CC=C3)CC(CN4C=NC=N4)(C5=C(C=C(C=C5)F)F)O

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=C(C=C2)OCC3=CC=CC=C3)CC(CN4C=NC=N4)(C5=C(C=C(C=C5)F)F)O

InChI

InChI=1S/C31H35F2N5O3/c32-26-7-12-29(30(33)19-26)31(39,22-38-24-34-23-35-38)21-37-16-14-36(15-17-37)13-4-18-40-27-8-10-28(11-9-27)41-20-25-5-2-1-3-6-25/h1-3,5-12,19,23-24,39H,4,13-18,20-22H2