N-(1,3-benzodioxol-5-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(4-ethyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propionamide Formula: C16H25N3O3+2 MolecularWeight: 307.388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H23N3O3/c1-2-18-7-9-19(10-8-18)6-5-16(20)17-13-3-4-14-15(11-13)22-12-21-14/h3-4,11H,2,5-10,12H2,1H3,(H,17,20)/p+2