2-iodanyl-N-(4-methylsulfanylphenyl)-5-nitro-benzamide

Systemtic Name: 2-iodanyl-N-(4-methylsulfanylphenyl)-5-nitro-benzamide Openeye Name: 2-iodo-N-(4-methylsulfanylphenyl)-5-nitro-benzamide CAS Name: 2-iodo-N-[4-(methylthio)phenyl]-5-nitrobenzamide IUPAC Name: 2-iodo-N-(4-methylsulfanylphenyl)-5-nitrobenzamide Traditional Name: 2-iodo-N-[4-(methylthio)phenyl]-5-nitro-benzamide Formula: C14H11IN2O3S MolecularWeight: 414.21821

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I

InChI

InChI=1S/C14H11IN2O3S/c1-21-11-5-2-9(3-6-11)16-14(18)12-8-10(17(19)20)4-7-13(12)15/h2-8H,1H3,(H,16,18)