N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(2-nitrophenyl)ethanamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(2-nitrophenyl)ethanamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(2-nitrophenyl)acetamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2-(2-nitrophenyl)acetamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-(2-nitrophenyl)acetamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-(2-nitrophenyl)acetamide Formula: C18H18ClN3O5S MolecularWeight: 423.87062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CC3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18ClN3O5S/c19-15-8-7-14(12-17(15)28(26,27)21-9-3-4-10-21)20-18(23)11-13-5-1-2-6-16(13)22(24)25/h1-2,5-8,12H,3-4,9-11H2,(H,20,23)