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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)Cl)OCC(C(N2CCCC2)OC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)Cl)OCC(C(N2CCCC2)OC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C21H24ClN3O6/c1-14(26)23-18-12-15(22)4-9-20(18)30-13-19(27)21(24-10-2-3-11-24)31-17-7-5-16(6-8-17)25(28)29/h4-9,12,19,21,27H,2-3,10-11,13H2,1H3,(H,23,26)