N-(4-methoxy-3-sulfamoyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(4-methoxy-3-sulfamoyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-methoxy-3-sulfamoyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-(4-methoxy-3-sulfamoylphenyl)-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-methoxy-3-sulfamoylphenyl)-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-methoxy-3-sulfamoyl-phenyl)-5-nitro-2-pyrrolidino-benzamide Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)S(=O)(=O)N

InChI

InChI=1S/C18H20N4O6S/c1-28-16-7-4-12(10-17(16)29(19,26)27)20-18(23)14-11-13(22(24)25)5-6-15(14)21-8-2-3-9-21/h4-7,10-11H,2-3,8-9H2,1H3,(H,20,23)(H2,19,26,27)