4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-N-phenyl-benzenesulfonamide Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-N-phenyl-benzenesulfonamide CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-N-phenylbenzenesulfonamide IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-N-phenylbenzenesulfonamide Traditional Name: N-phenyl-4-(4-piperonylpiperazine-1-carbonyl)benzenesulfonamide Formula: C25H25N3O5S MolecularWeight: 479.5481

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)S(=O)(=O)NC5=CC=CC=C5

InChI

InChI=1S/C25H25N3O5S/c29-25(20-7-9-22(10-8-20)34(30,31)26-21-4-2-1-3-5-21)28-14-12-27(13-15-28)17-19-6-11-23-24(16-19)33-18-32-23/h1-11,16,26H,12-15,17-18H2