2-[(4-ethylpiperazin-4-ium-1-yl)methyl]aniline

Systemtic Name: 2-[(4-ethylpiperazin-4-ium-1-yl)methyl]aniline Openeye Name: 2-[(4-ethylpiperazin-4-ium-1-yl)methyl]aniline CAS Name: 2-[(4-ethyl-1-piperazin-4-iumyl)methyl]aniline IUPAC Name: 2-[(4-ethylpiperazin-4-ium-1-yl)methyl]aniline Traditional Name: [2-[(4-ethylpiperazin-4-ium-1-yl)methyl]phenyl]amine Formula: C13H22N3+ MolecularWeight: 220.33388

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC=CC=C2N

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC=CC=C2N

InChI

InChI=1S/C13H21N3/c1-2-15-7-9-16(10-8-15)11-12-5-3-4-6-13(12)14/h3-6H,2,7-11,14H2,1H3/p+1