4-chloranyl-N-(2-methylsulfanylphenyl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(2-methylsulfanylphenyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(2-methylsulfanylphenyl)-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(methylthio)phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-(2-methylsulfanylphenyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(methylthio)phenyl]-3-nitro-benzamide Formula: C14H11ClN2O3S MolecularWeight: 322.76674

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H11ClN2O3S/c1-21-13-5-3-2-4-11(13)16-14(18)9-6-7-10(15)12(8-9)17(19)20/h2-8H,1H3,(H,16,18)