N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C21H25ClN3O3+ MolecularWeight: 402.8945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H24ClN3O3/c1-24-6-8-25(9-7-24)18-4-3-16(22)14-17(18)23-21(26)13-15-2-5-19-20(12-15)28-11-10-27-19/h2-5,12,14H,6-11,13H2,1H3,(H,23,26)/p+1