N-(2-hydroxyethyl)-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-(2-hydroxyethyl)-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(2-hydroxyethyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-(2-hydroxyethyl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-(2-hydroxyethyl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(2-hydroxyethyl)-4-(methylthio)-3-nitro-benzamide Formula: C10H12N2O4S MolecularWeight: 256.27828

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NCCO)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NCCO)[N+](=O)[O-]

InChI

InChI=1S/C10H12N2O4S/c1-17-9-3-2-7(6-8(9)12(15)16)10(14)11-4-5-13/h2-3,6,13H,4-5H2,1H3,(H,11,14)