1-[4-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]piperidin-1-yl]ethanone

Systemtic Name: 1-[4-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]piperidin-1-yl]ethanone Openeye Name: 1-[4-(4-benzylpiperazine-1,4-diium-1-yl)-1-piperidyl]ethanone CAS Name: 1-[4-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-(4-benzylpiperazine-1,4-diium-1-yl)piperidin-1-yl]ethanone Traditional Name: 1-[4-(4-benzylpiperazine-1,4-diium-1-yl)piperidino]ethanone Formula: C18H29N3O+2 MolecularWeight: 303.44236

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CCC(CC1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H27N3O/c1-16(22)20-9-7-18(8-10-20)21-13-11-19(12-14-21)15-17-5-3-2-4-6-17/h2-6,18H,7-15H2,1H3/p+2