1-(1,3-benzodioxol-5-yl)-4-(2-chloranyl-4-fluoranyl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-4-(2-chloranyl-4-fluoranyl-phenyl)sulfonyl-piperazine Openeye Name: 1-(1,3-benzodioxol-5-yl)-4-(2-chloro-4-fluoro-phenyl)sulfonyl-piperazine CAS Name: 1-(1,3-benzodioxol-5-yl)-4-(2-chloro-4-fluorophenyl)sulfonylpiperazine IUPAC Name: 1-(1,3-benzodioxol-5-yl)-4-(2-chloro-4-fluorophenyl)sulfonylpiperazine Traditional Name: 1-(1,3-benzodioxol-5-yl)-4-(2-chloro-4-fluoro-phenyl)sulfonyl-piperazine Formula: C17H16ClFN2O4S MolecularWeight: 398.836343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C17H16ClFN2O4S/c18-14-9-12(19)1-4-17(14)26(22,23)21-7-5-20(6-8-21)13-2-3-15-16(10-13)25-11-24-15/h1-4,9-10H,5-8,11H2