N-(2-chloranyl-5-nitro-phenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide CAS Name: N-(2-chloro-5-nitrophenyl)-4-(1-pyrrolidinylsulfonylmethyl)benzamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-4-(pyrrolidinosulfonylmethyl)benzamide Formula: C18H18ClN3O5S MolecularWeight: 423.87062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClN3O5S/c19-16-8-7-15(22(24)25)11-17(16)20-18(23)14-5-3-13(4-6-14)12-28(26,27)21-9-1-2-10-21/h3-8,11H,1-2,9-10,12H2,(H,20,23)