N-methyl-2-[4-[3-(4-nitrophenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-phenyl-ethanamide

Systemtic Name: N-methyl-2-[4-[3-(4-nitrophenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-[2-hydroxy-3-(4-nitrophenoxy)propyl]piperazin-1-yl]-N-methyl-N-phenyl-acetamide CAS Name: 2-[4-[2-hydroxy-3-(4-nitrophenoxy)propyl]-1-piperazinyl]-N-methyl-N-phenylacetamide IUPAC Name: 2-[4-[2-hydroxy-3-(4-nitrophenoxy)propyl]piperazin-1-yl]-N-methyl-N-phenylacetamide Traditional Name: 2-[4-[2-hydroxy-3-(4-nitrophenoxy)propyl]piperazino]-N-methyl-N-phenyl-acetamide Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CN2CCN(CC2)CC(COC3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C22H28N4O5/c1-23(18-5-3-2-4-6-18)22(28)16-25-13-11-24(12-14-25)15-20(27)17-31-21-9-7-19(8-10-21)26(29)30/h2-10,20,27H,11-17H2,1H3