2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(2-furoyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazino)ethanone Formula: C21H27N4O3+ MolecularWeight: 383.46408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CC=CO4

InChI

InChI=1S/C21H26N4O3/c26-20(24-14-12-23(13-15-24)18-5-2-1-3-6-18)17-22-8-10-25(11-9-22)21(27)19-7-4-16-28-19/h1-7,16H,8-15,17H2/p+1