4-(4-bromophenyl)-1-[3-(4-nitrophenoxy)-2-oxidanyl-propyl]piperidin-4-ol

Systemtic Name: 4-(4-bromophenyl)-1-[3-(4-nitrophenoxy)-2-oxidanyl-propyl]piperidin-4-ol Openeye Name: 4-(4-bromophenyl)-1-[2-hydroxy-3-(4-nitrophenoxy)propyl]piperidin-4-ol CAS Name: 4-(4-bromophenyl)-1-[2-hydroxy-3-(4-nitrophenoxy)propyl]-4-piperidinol IUPAC Name: 4-(4-bromophenyl)-1-[2-hydroxy-3-(4-nitrophenoxy)propyl]piperidin-4-ol Traditional Name: 4-(4-bromophenyl)-1-[2-hydroxy-3-(4-nitrophenoxy)propyl]piperidin-4-ol Formula: C20H23BrN2O5 MolecularWeight: 451.31102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Br)O)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Br)O)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H23BrN2O5/c21-16-3-1-15(2-4-16)20(25)9-11-22(12-10-20)13-18(24)14-28-19-7-5-17(6-8-19)23(26)27/h1-8,18,24-25H,9-14H2