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

Systemtic Name: 1-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazin-4-ium Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)piperazin-4-ium CAS Name: 1-[1-(phenylmethyl)-4-piperidin-1-iumyl]piperazin-4-ium IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)piperazin-4-ium Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)piperazin-4-ium Formula: C16H27N3+2 MolecularWeight: 261.40568

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CC[NH2+]CC2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1N2CC[NH2+]CC2)CC3=CC=CC=C3

InChI

InChI=1S/C16H25N3/c1-2-4-15(5-3-1)14-18-10-6-16(7-11-18)19-12-8-17-9-13-19/h1-5,16-17H,6-14H2/p+2