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

Systemtic Name: 3-chloranyl-N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]propanamide Openeye Name: 3-chloro-N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]propanamide CAS Name: 3-chloro-N-[3-(2-hydroxyethylthio)-5-nitrophenyl]propanamide IUPAC Name: 3-chloro-N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]propanamide Traditional Name: 3-chloro-N-[3-(2-hydroxyethylthio)-5-nitro-phenyl]propionamide Formula: C11H13ClN2O4S MolecularWeight: 304.74992

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])SCCO)NC(=O)CCCl

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])SCCO)NC(=O)CCCl

InChI

InChI=1S/C11H13ClN2O4S/c12-2-1-11(16)13-8-5-9(14(17)18)7-10(6-8)19-4-3-15/h5-7,15H,1-4H2,(H,13,16)