methyl-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]azanium

Systemtic Name: methyl-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]azanium Openeye Name: 2-(4-benzylpiperazin-4-ium-1-yl)ethyl-methyl-ammonium CAS Name: methyl-[2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]ammonium IUPAC Name: 2-(4-benzylpiperazin-4-ium-1-yl)ethyl-methylazanium Traditional Name: 2-(4-benzylpiperazin-4-ium-1-yl)ethyl-methyl-ammonium Formula: C14H25N3+2 MolecularWeight: 235.3684

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCN1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

C[NH2+]CCN1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C14H23N3/c1-15-7-8-16-9-11-17(12-10-16)13-14-5-3-2-4-6-14/h2-6,15H,7-13H2,1H3/p+2