2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-(2,3-dihydro-1H-inden-2-yl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-(2,3-dihydro-1H-inden-2-yl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-indan-2-yl-acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-1-iumyl]-N-(2,3-dihydro-1H-inden-2-yl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium-1-yl]-N-(2,3-dihydro-1H-inden-2-yl)acetamide Traditional Name: N-indan-2-yl-2-(4-piperonylpiperazin-1-ium-1-yl)acetamide Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2CC3=CC=CC=C3C2)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2CC3=CC=CC=C3C2)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H27N3O3/c27-23(24-20-12-18-3-1-2-4-19(18)13-20)15-26-9-7-25(8-10-26)14-17-5-6-21-22(11-17)29-16-28-21/h1-6,11,20H,7-10,12-16H2,(H,24,27)/p+1