4-[2,6-dimethyl-1-(phenylmethyl)piperazin-1-ium-1-yl]butan-1-amine

Systemtic Name: 4-[2,6-dimethyl-1-(phenylmethyl)piperazin-1-ium-1-yl]butan-1-amine Openeye Name: 4-(1-benzyl-2,6-dimethyl-piperazin-1-ium-1-yl)butan-1-amine CAS Name: 4-[2,6-dimethyl-1-(phenylmethyl)-1-piperazin-1-iumyl]-1-butanamine IUPAC Name: 4-(1-benzyl-2,6-dimethylpiperazin-1-ium-1-yl)butan-1-amine Traditional Name: 4-(1-benzyl-2,6-dimethyl-piperazin-1-ium-1-yl)butylamine Formula: C17H30N3+ MolecularWeight: 276.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCC([N+]1(CCCCN)CC2=CC=CC=C2)C

Isomeric SMILES

CC1CNCC([N+]1(CCCCN)CC2=CC=CC=C2)C

InChI

InChI=1S/C17H30N3/c1-15-12-19-13-16(2)20(15,11-7-6-10-18)14-17-8-4-3-5-9-17/h3-5,8-9,15-16,19H,6-7,10-14,18H2,1-2H3/q+1