5-bromanyl-2-(4-ethylpiperazin-4-ium-1-yl)aniline

Systemtic Name: 5-bromanyl-2-(4-ethylpiperazin-4-ium-1-yl)aniline Openeye Name: 5-bromo-2-(4-ethylpiperazin-4-ium-1-yl)aniline CAS Name: 5-bromo-2-(4-ethyl-1-piperazin-4-iumyl)aniline IUPAC Name: 5-bromo-2-(4-ethylpiperazin-4-ium-1-yl)aniline Traditional Name: [5-bromo-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]amine Formula: C12H19BrN3+ MolecularWeight: 285.20336

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Br)N

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Br)N

InChI

InChI=1S/C12H18BrN3/c1-2-15-5-7-16(8-6-15)12-4-3-10(13)9-11(12)14/h3-4,9H,2,5-8,14H2,1H3/p+1