N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C20H21ClN2O5S MolecularWeight: 436.90914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

InChI

InChI=1S/C20H21ClN2O5S/c1-13(14-4-7-18-19(10-14)28-12-27-18)22-20(24)16-11-15(5-6-17(16)21)29(25,26)23-8-2-3-9-23/h4-7,10-11,13H,2-3,8-9,12H2,1H3,(H,22,24)