N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-piperonyl-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N2O5S/c24-21(22-14-17-5-9-19-20(13-17)28-15-27-19)10-6-16-3-7-18(8-4-16)29(25,26)23-11-1-2-12-23/h3-5,7-9,13H,1-2,6,10-12,14-15H2,(H,22,24)