3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(pyrrolidinomethyl)benzyl]propionamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC=C2CNC(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(C1)CC2=CC=CC=C2CNC(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H28N2O5S/c26-23(24-16-18-5-1-2-6-19(18)17-25-10-3-4-11-25)9-14-31(27,28)20-7-8-21-22(15-20)30-13-12-29-21/h1-2,5-8,15H,3-4,9-14,16-17H2,(H,24,26)