1-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-2-(4-chlorophenyl)ethenyl]sulfonyl-piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-2-(4-chlorophenyl)ethenyl]sulfonyl-piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-2-(4-chlorophenyl)vinyl]sulfonyl-piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-2-(4-chlorophenyl)ethenyl]sulfonylpiperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(E)-2-(4-chlorophenyl)ethenyl]sulfonylpiperazine Traditional Name: 1-[(E)-2-(4-chlorophenyl)vinyl]sulfonyl-4-piperonyl-piperazine Formula: C20H21ClN2O4S MolecularWeight: 420.90974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C=CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)S(=O)(=O)/C=C/C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN2O4S/c21-18-4-1-16(2-5-18)7-12-28(24,25)23-10-8-22(9-11-23)14-17-3-6-19-20(13-17)27-15-26-19/h1-7,12-13H,8-11,14-15H2/b12-7+