(7-chloranyl-1,3-benzodioxol-5-yl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (7-chloro-1,3-benzodioxol-5-yl)-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (7-chloro-1,3-benzodioxol-5-yl)-[4-(3-fluorophenyl)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)Cl)OCO3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

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

InChI

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