N-[5-chloranyl-2-[3-[3-(4-nitrophenoxy)pyrrolidin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanamide

Systemtic Name: N-[5-chloranyl-2-[3-[3-(4-nitrophenoxy)pyrrolidin-1-yl]-2-oxidanyl-propoxy]phenyl]ethanamide Openeye Name: N-[5-chloro-2-[2-hydroxy-3-[3-(4-nitrophenoxy)pyrrolidin-1-yl]propoxy]phenyl]acetamide CAS Name: N-[5-chloro-2-[2-hydroxy-3-[3-(4-nitrophenoxy)-1-pyrrolidinyl]propoxy]phenyl]acetamide IUPAC Name: N-[5-chloro-2-[2-hydroxy-3-[3-(4-nitrophenoxy)pyrrolidin-1-yl]propoxy]phenyl]acetamide Traditional Name: N-[5-chloro-2-[2-hydroxy-3-[3-(4-nitrophenoxy)pyrrolidino]propoxy]phenyl]acetamide Formula: C21H24ClN3O6 MolecularWeight: 449.88476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)Cl)OCC(CN2CCC(C2)OC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)Cl)OCC(CN2CCC(C2)OC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C21H24ClN3O6/c1-14(26)23-20-10-15(22)2-7-21(20)30-13-17(27)11-24-9-8-19(12-24)31-18-5-3-16(4-6-18)25(28)29/h2-7,10,17,19,27H,8-9,11-13H2,1H3,(H,23,26)