1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-[1-(3-nitrophenyl)ethyl]piperazine

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-4-[1-(3-nitrophenyl)ethyl]piperazine Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-[1-(3-nitrophenyl)ethyl]piperazine CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-[1-(3-nitrophenyl)ethyl]piperazine IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-4-[1-(3-nitrophenyl)ethyl]piperazine Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-[1-(3-nitrophenyl)ethyl]piperazine Formula: C18H19ClFN3O4S MolecularWeight: 427.877563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H19ClFN3O4S/c1-13(14-3-2-4-15(11-14)23(24)25)21-7-9-22(10-8-21)28(26,27)16-5-6-18(20)17(19)12-16/h2-6,11-13H,7-10H2,1H3