2-(4-phenethylpiperazin-4-ium-1-yl)aniline

Systemtic Name: 2-(4-phenethylpiperazin-4-ium-1-yl)aniline Openeye Name: 2-(4-phenethylpiperazin-4-ium-1-yl)aniline CAS Name: 2-(4-phenethyl-1-piperazin-4-iumyl)aniline IUPAC Name: 2-(4-phenethylpiperazin-4-ium-1-yl)aniline Traditional Name: [2-(4-phenethylpiperazin-4-ium-1-yl)phenyl]amine Formula: C18H24N3+ MolecularWeight: 282.40326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C3=CC=CC=C3N

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C3=CC=CC=C3N

InChI

InChI=1S/C18H23N3/c19-17-8-4-5-9-18(17)21-14-12-20(13-15-21)11-10-16-6-2-1-3-7-16/h1-9H,10-15,19H2/p+1