N-(2,5-dimethoxyphenyl)-5-methylsulfanyl-2-nitro-benzamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-5-methylsulfanyl-2-nitro-benzamide Openeye Name: N-(2,5-dimethoxyphenyl)-5-methylsulfanyl-2-nitro-benzamide CAS Name: N-(2,5-dimethoxyphenyl)-5-(methylthio)-2-nitrobenzamide IUPAC Name: N-(2,5-dimethoxyphenyl)-5-methylsulfanyl-2-nitrobenzamide Traditional Name: N-(2,5-dimethoxyphenyl)-5-(methylthio)-2-nitro-benzamide Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C=CC(=C2)SC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C=CC(=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S/c1-22-10-4-7-15(23-2)13(8-10)17-16(19)12-9-11(24-3)5-6-14(12)18(20)21/h4-9H,1-3H3,(H,17,19)