4-(2-hydroxyethylsulfanylmethyl)-3-nitro-benzamide

Systemtic Name: 4-(2-hydroxyethylsulfanylmethyl)-3-nitro-benzamide Openeye Name: 4-(2-hydroxyethylsulfanylmethyl)-3-nitro-benzamide CAS Name: 4-[(2-hydroxyethylthio)methyl]-3-nitrobenzamide IUPAC Name: 4-(2-hydroxyethylsulfanylmethyl)-3-nitrobenzamide Traditional Name: 4-[(2-hydroxyethylthio)methyl]-3-nitro-benzamide Formula: C10H12N2O4S MolecularWeight: 256.27828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CSCCO

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CSCCO

InChI

InChI=1S/C10H12N2O4S/c11-10(14)7-1-2-8(6-17-4-3-13)9(5-7)12(15)16/h1-2,5,13H,3-4,6H2,(H2,11,14)