2-phenoxy-1-(4-piperidin-1-ium-4-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-phenoxy-1-(4-piperidin-1-ium-4-ylpiperazin-1-yl)ethanone Openeye Name: 2-phenoxy-1-(4-piperidin-1-ium-4-ylpiperazin-1-yl)ethanone CAS Name: 2-phenoxy-1-[4-(4-piperidin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-phenoxy-1-(4-piperidin-1-ium-4-ylpiperazin-1-yl)ethanone Traditional Name: 2-phenoxy-1-(4-piperidin-1-ium-4-ylpiperazino)ethanone Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1N2CCN(CC2)C(=O)COC3=CC=CC=C3

Isomeric SMILES

C1C[NH2+]CCC1N2CCN(CC2)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C17H25N3O2/c21-17(14-22-16-4-2-1-3-5-16)20-12-10-19(11-13-20)15-6-8-18-9-7-15/h1-5,15,18H,6-14H2/p+1