N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-4-(methylamino)-3-nitro-benzamide CAS Name: N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]-4-(methylamino)-3-nitrobenzamide Traditional Name: N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-4-(methylamino)-3-nitro-benzamide Formula: C18H22N4O6S MolecularWeight: 422.45548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-])S(=O)(=O)N(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-])S(=O)(=O)N(C)C

InChI

InChI=1S/C18H22N4O6S/c1-5-28-16-9-7-13(11-17(16)29(26,27)21(3)4)20-18(23)12-6-8-14(19-2)15(10-12)22(24)25/h6-11,19H,5H2,1-4H3,(H,20,23)