N-(1,3-benzodioxol-5-yl)-3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[4-(5-bromo-2-pyridyl)piperazin-1-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-[4-(5-bromopyridin-2-yl)piperazin-1-yl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[4-(5-bromo-2-pyridyl)piperazino]propionamide Formula: C19H21BrN4O3 MolecularWeight: 433.29904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC3=C(C=C2)OCO3)C4=NC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC3=C(C=C2)OCO3)C4=NC=C(C=C4)Br

InChI

InChI=1S/C19H21BrN4O3/c20-14-1-4-18(21-12-14)24-9-7-23(8-10-24)6-5-19(25)22-15-2-3-16-17(11-15)27-13-26-16/h1-4,11-12H,5-10,13H2,(H,22,25)