[1-(naphthalen-1-ylmethyl)piperidin-1-ium-4-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [1-(naphthalen-1-ylmethyl)piperidin-1-ium-4-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(1-naphthylmethyl)piperidin-1-ium-4-yl]methanone CAS Name: [1-(1-naphthalenylmethyl)-4-piperidin-1-iumyl]-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(naphthalen-1-ylmethyl)piperidin-1-ium-4-yl]methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(1-naphthylmethyl)piperidin-1-ium-4-yl]methanone Formula: C28H35N3O+2 MolecularWeight: 429.597

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H33N3O/c32-28(31-19-17-30(18-20-31)21-23-7-2-1-3-8-23)25-13-15-29(16-14-25)22-26-11-6-10-24-9-4-5-12-27(24)26/h1-12,25H,13-22H2/p+2