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

Systemtic Name: N-(2-ethoxyphenyl)-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(2-ethoxyphenyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-(2-ethoxyphenyl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-(2-ethoxyphenyl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: 4-(methylthio)-3-nitro-N-o-phenetyl-benzamide Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O4S/c1-3-22-14-7-5-4-6-12(14)17-16(19)11-8-9-15(23-2)13(10-11)18(20)21/h4-10H,3H2,1-2H3,(H,17,19)