3,4-diethoxy-N-(2-nitro-5-propylsulfanyl-phenyl)benzamide

Systemtic Name: 3,4-diethoxy-N-(2-nitro-5-propylsulfanyl-phenyl)benzamide Openeye Name: 3,4-diethoxy-N-(2-nitro-5-propylsulfanyl-phenyl)benzamide CAS Name: 3,4-diethoxy-N-[2-nitro-5-(propylthio)phenyl]benzamide IUPAC Name: 3,4-diethoxy-N-(2-nitro-5-propylsulfanylphenyl)benzamide Traditional Name: 3,4-diethoxy-N-[2-nitro-5-(propylthio)phenyl]benzamide Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=C(C=C2)OCC)OCC

Isomeric SMILES

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=C(C=C2)OCC)OCC

InChI

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