N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-nitro-4-pyrrolidino-benzamide Formula: C23H30N4O5S MolecularWeight: 474.5731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O5S/c1-4-26(5-2)33(31,32)20-11-8-18(9-12-20)17(3)24-23(28)19-10-13-21(22(16-19)27(29)30)25-14-6-7-15-25/h8-13,16-17H,4-7,14-15H2,1-3H3,(H,24,28)