N-(4-chloranyl-3-nitro-phenyl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(4-chloro-3-nitrophenyl)-2-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(4-chloro-3-nitro-phenyl)-2-[4-(3-fluorophenyl)sulfonylpiperazino]acetamide Formula: C18H18ClFN4O5S MolecularWeight: 456.875723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C18H18ClFN4O5S/c19-16-5-4-14(11-17(16)24(26)27)21-18(25)12-22-6-8-23(9-7-22)30(28,29)15-3-1-2-13(20)10-15/h1-5,10-11H,6-9,12H2,(H,21,25)