1-(naphthalen-1-ylmethyl)-4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium

Systemtic Name: 1-(naphthalen-1-ylmethyl)-4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazine-1,4-diium Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(1-naphthylmethyl)piperazine-1,4-diium CAS Name: 1-(1-naphthalenylmethyl)-4-[1-(phenylmethyl)-4-piperidin-1-iumyl]piperazine-1,4-diium IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(naphthalen-1-ylmethyl)piperazine-1,4-diium Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(1-naphthylmethyl)piperazine-1,4-diium Formula: C27H36N3+3 MolecularWeight: 402.59484

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C27H33N3/c1-2-7-23(8-3-1)21-28-15-13-26(14-16-28)30-19-17-29(18-20-30)22-25-11-6-10-24-9-4-5-12-27(24)25/h1-12,26H,13-22H2/p+3