4-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]aniline

Systemtic Name: 4-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]aniline Openeye Name: 4-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]aniline CAS Name: 4-[2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]aniline IUPAC Name: 4-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]aniline Traditional Name: [4-[2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]phenyl]amine Formula: C17H23N4+ MolecularWeight: 283.39132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)N)C3=CC=CC=[NH+]3

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)N)C3=CC=CC=[NH+]3

InChI

InChI=1S/C17H22N4/c18-16-6-4-15(5-7-16)8-10-20-11-13-21(14-12-20)17-3-1-2-9-19-17/h1-7,9H,8,10-14,18H2/p+1