4-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]aniline

Systemtic Name: 4-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]aniline Openeye Name: 4-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]aniline CAS Name: 4-[4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]-1-piperazin-4-iumyl]aniline IUPAC Name: 4-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]aniline Traditional Name: [4-[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazin-4-ium-1-yl]phenyl]amine Formula: C17H26N5+ MolecularWeight: 300.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C[NH+]2CCN(CC2)C3=CC=C(C=C3)N

Isomeric SMILES

CC1=C(C(=NN1C)C)C[NH+]2CCN(CC2)C3=CC=C(C=C3)N

InChI

InChI=1S/C17H25N5/c1-13-17(14(2)20(3)19-13)12-21-8-10-22(11-9-21)16-6-4-15(18)5-7-16/h4-7H,8-12,18H2,1-3H3/p+1