2-chloranyl-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-pyrrolidin-1-ylphenyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[5-(diethylsulfamoyl)-2-pyrrolidino-phenyl]-5-nitro-benzamide Formula: C21H25ClN4O5S MolecularWeight: 480.965

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H25ClN4O5S/c1-3-25(4-2)32(30,31)16-8-10-20(24-11-5-6-12-24)19(14-16)23-21(27)17-13-15(26(28)29)7-9-18(17)22/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,23,27)