1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol

Systemtic Name: 1-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol Openeye Name: 1-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol CAS Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-3-(4-nitrophenoxy)-2-propanol IUPAC Name: 1-[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]-3-(4-nitrophenoxy)propan-2-ol Traditional Name: 1-[4-(2-chloro-6-fluoro-benzyl)piperazino]-3-(4-nitrophenoxy)propan-2-ol Formula: C20H23ClFN3O4 MolecularWeight: 423.865723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC=C2Cl)F)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC=C2Cl)F)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H23ClFN3O4/c21-19-2-1-3-20(22)18(19)13-24-10-8-23(9-11-24)12-16(26)14-29-17-6-4-15(5-7-17)25(27)28/h1-7,16,26H,8-14H2