2-[methyl-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[methyl-[3-(3-nitrophenoxy)-2-oxidanyl-propyl]amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[[2-hydroxy-3-(3-nitrophenoxy)propyl]-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[[2-hydroxy-3-(3-nitrophenoxy)propyl]-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[[2-hydroxy-3-(3-nitrophenoxy)propyl]-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[[2-hydroxy-3-(3-nitrophenoxy)propyl]-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(COC1=CC=CC(=C1)[N+](=O)[O-])O)CC(=O)NC2=CC=CC=C2SC

Isomeric SMILES

CN(CC(COC1=CC=CC(=C1)[N+](=O)[O-])O)CC(=O)NC2=CC=CC=C2SC

InChI

InChI=1S/C19H23N3O5S/c1-21(12-19(24)20-17-8-3-4-9-18(17)28-2)11-15(23)13-27-16-7-5-6-14(10-16)22(25)26/h3-10,15,23H,11-13H2,1-2H3,(H,20,24)