1,3-benzodioxol-5-yl-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]methanone Formula: C18H16ClFN2O5S MolecularWeight: 426.846443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C18H16ClFN2O5S/c19-14-10-13(2-3-15(14)20)28(24,25)22-7-5-21(6-8-22)18(23)12-1-4-16-17(9-12)27-11-26-16/h1-4,9-10H,5-8,11H2