1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-2-(2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-2-(2,3-dihydroindol-1-yl)ethanone Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-2-indolin-1-yl-ethanone CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]-2-(2,3-dihydroindol-1-yl)ethanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-2-(2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-indolin-1-yl-1-(4-piperonylpiperazin-4-ium-1-yl)ethanone Formula: C22H26N3O3+ MolecularWeight: 380.46014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)CC(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(C2=CC=CC=C21)CC(=O)N3CC[NH+](CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H25N3O3/c26-22(15-25-8-7-18-3-1-2-4-19(18)25)24-11-9-23(10-12-24)14-17-5-6-20-21(13-17)28-16-27-20/h1-6,13H,7-12,14-16H2/p+1