2-methoxy-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-benzamide

Systemtic Name: 2-methoxy-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-benzamide Openeye Name: 2-methoxy-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitro-benzamide CAS Name: 2-methoxy-N-methyl-N-[[4-(methylthio)phenyl]methyl]-5-nitrobenzamide IUPAC Name: 2-methoxy-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-nitrobenzamide Traditional Name: 2-methoxy-N-methyl-N-[4-(methylthio)benzyl]-5-nitro-benzamide Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C17H18N2O4S/c1-18(11-12-4-7-14(24-3)8-5-12)17(20)15-10-13(19(21)22)6-9-16(15)23-2/h4-10H,11H2,1-3H3