1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chlorophenyl)methylsulfonyl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chlorophenyl)methylsulfonyl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chlorophenyl)methylsulfonyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chlorophenyl)methylsulfonyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-chlorophenyl)methylsulfonyl]piperazine Traditional Name: 1-(4-chlorobenzyl)sulfonyl-4-piperonyl-piperazine Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O4S/c20-17-4-1-15(2-5-17)13-27(23,24)22-9-7-21(8-10-22)12-16-3-6-18-19(11-16)26-14-25-18/h1-6,11H,7-10,12-14H2