N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[3-(3,4-dimethoxyphenyl)propyl]-N-methyl-4-(methylthio)-3-nitro-benzamide Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CN(CCCC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O5S/c1-21(11-5-6-14-7-9-17(26-2)18(12-14)27-3)20(23)15-8-10-19(28-4)16(13-15)22(24)25/h7-10,12-13H,5-6,11H2,1-4H3