N-(1,3-benzodioxol-5-ylmethyl)-3-(2-phenylpyrrolidin-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-phenylpyrrolidin-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-phenylpyrrolidine-1-carbonyl)benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[oxo-(2-phenyl-1-pyrrolidinyl)methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(2-phenylpyrrolidine-1-carbonyl)benzenesulfonamide Traditional Name: 3-(2-phenylpyrrolidine-1-carbonyl)-N-piperonyl-benzenesulfonamide Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N2O5S/c28-25(27-13-5-10-22(27)19-6-2-1-3-7-19)20-8-4-9-21(15-20)33(29,30)26-16-18-11-12-23-24(14-18)32-17-31-23/h1-4,6-9,11-12,14-15,22,26H,5,10,13,16-17H2