N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-pyrrolidinosulfonyl-benzamide Formula: C20H22N2O5S MolecularWeight: 402.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H22N2O5S/c23-20(21-14-15-3-8-18-19(13-15)27-12-11-26-18)16-4-6-17(7-5-16)28(24,25)22-9-1-2-10-22/h3-8,13H,1-2,9-12,14H2,(H,21,23)