N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]propanamide

Systemtic Name: N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]propanamide Openeye Name: N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]propanamide CAS Name: N-[3-(2-hydroxyethylthio)-5-nitrophenyl]propanamide IUPAC Name: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]propanamide Traditional Name: N-[3-(2-hydroxyethylthio)-5-nitro-phenyl]propionamide Formula: C11H14N2O4S MolecularWeight: 270.30486

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC(=C1)SCCO)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC(=CC(=C1)SCCO)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O4S/c1-2-11(15)12-8-5-9(13(16)17)7-10(6-8)18-4-3-14/h5-7,14H,2-4H2,1H3,(H,12,15)