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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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