3-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-N-(4-nitrophenyl)propanamide Openeye Name: 3-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-N-(4-nitrophenyl)propanamide CAS Name: 3-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-N-(4-nitrophenyl)propanamide IUPAC Name: 3-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-N-(4-nitrophenyl)propanamide Traditional Name: 3-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-N-(4-nitrophenyl)propionamide Formula: C19H20ClFN4O5S MolecularWeight: 470.902303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C19H20ClFN4O5S/c20-17-13-16(5-6-18(17)21)31(29,30)24-11-9-23(10-12-24)8-7-19(26)22-14-1-3-15(4-2-14)25(27)28/h1-6,13H,7-12H2,(H,22,26)