1-phenethyl-4-pyridin-1-ium-2-yl-piperazin-1-ium

Systemtic Name: 1-phenethyl-4-pyridin-1-ium-2-yl-piperazin-1-ium Openeye Name: 1-phenethyl-4-pyridin-1-ium-2-yl-piperazin-1-ium CAS Name: 1-phenethyl-4-(2-pyridin-1-iumyl)piperazin-1-ium IUPAC Name: 1-phenethyl-4-pyridin-1-ium-2-ylpiperazin-1-ium Traditional Name: 1-phenethyl-4-pyridin-1-ium-2-yl-piperazin-1-ium Formula: C17H23N3+2 MolecularWeight: 269.38462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C3=CC=CC=[NH+]3

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C17H21N3/c1-2-6-16(7-3-1)9-11-19-12-14-20(15-13-19)17-8-4-5-10-18-17/h1-8,10H,9,11-15H2/p+2