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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propionamide Formula: C17H27N3O3+2 MolecularWeight: 321.41458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O3/c1-2-19-7-9-20(10-8-19)6-5-17(21)18-14-3-4-15-16(13-14)23-12-11-22-15/h3-4,13H,2,5-12H2,1H3,(H,18,21)/p+2