N,N-diethyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]aniline

Systemtic Name: N,N-diethyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]aniline Openeye Name: N,N-diethyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]aniline CAS Name: N,N-diethyl-4-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]aniline IUPAC Name: N,N-diethyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]aniline Traditional Name: diethyl-[4-[(4-pyridin-1-ium-2-ylpiperazino)methyl]phenyl]amine Formula: C20H29N4+ MolecularWeight: 325.47106

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C20H28N4/c1-3-23(4-2)19-10-8-18(9-11-19)17-22-13-15-24(16-14-22)20-7-5-6-12-21-20/h5-12H,3-4,13-17H2,1-2H3/p+1