2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-N-[(4-ethylphenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-N-[(4-ethylphenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-N-[(4-ethylphenyl)methyl]-N-methyl-acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazine-1,4-diiumyl]-N-[(4-ethylphenyl)methyl]-N-methylacetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-N-[(4-ethylphenyl)methyl]-N-methylacetamide Traditional Name: N-(4-ethylbenzyl)-N-methyl-2-(4-piperonylpiperazine-1,4-diium-1-yl)acetamide Formula: C24H33N3O3+2 MolecularWeight: 411.53712

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C(=O)C[NH+]2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C(=O)C[NH+]2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H31N3O3/c1-3-19-4-6-20(7-5-19)15-25(2)24(28)17-27-12-10-26(11-13-27)16-21-8-9-22-23(14-21)30-18-29-22/h4-9,14H,3,10-13,15-18H2,1-2H3/p+2