1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine

Systemtic Name: 1-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine Openeye Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine CAS Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-(3-fluorophenyl)sulfonylpiperazine IUPAC Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-(3-fluorophenyl)sulfonylpiperazine Traditional Name: 1-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-4-(3-fluorophenyl)sulfonyl-piperazine Formula: C19H20ClFN2O4S MolecularWeight: 426.889503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C3C(=CC(=C2)Cl)COCO3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CN(CCN1CC2=C3C(=CC(=C2)Cl)COCO3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C19H20ClFN2O4S/c20-16-8-14(19-15(9-16)12-26-13-27-19)11-22-4-6-23(7-5-22)28(24,25)18-3-1-2-17(21)10-18/h1-3,8-10H,4-7,11-13H2