N-[[1-(phenylsulfonyl)pyrrolidin-2-yl]methyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[1-(phenylsulfonyl)pyrrolidin-2-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[1-(benzenesulfonyl)pyrrolidin-2-yl]methyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[1-(benzenesulfonyl)-2-pyrrolidinyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[1-(benzenesulfonyl)pyrrolidin-2-yl]methyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(1-besylpyrrolidin-2-yl)methyl]-piperonylamide Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5S/c22-19(14-8-9-17-18(11-14)26-13-25-17)20-12-15-5-4-10-21(15)27(23,24)16-6-2-1-3-7-16/h1-3,6-9,11,15H,4-5,10,12-13H2,(H,20,22)