N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C16H25N3O3+2 MolecularWeight: 307.388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H23N3O3/c1-18-6-8-19(9-7-18)5-4-16(20)17-13-2-3-14-15(12-13)22-11-10-21-14/h2-3,12H,4-11H2,1H3,(H,17,20)/p+2