1-[(3-methylpyridin-2-yl)methyl]-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-ium

Systemtic Name: 1-[(3-methylpyridin-2-yl)methyl]-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-ium Openeye Name: 1-[(3-methyl-2-pyridyl)methyl]-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-ium CAS Name: 1-[(3-methyl-2-pyridinyl)methyl]-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-ium IUPAC Name: 1-[(3-methylpyridin-2-yl)methyl]-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-ium Traditional Name: 1-[(3-methyl-2-pyridyl)methyl]-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperazin-1-ium Formula: C21H26N5+ MolecularWeight: 348.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C[NH+]2CCN(CC2)CC3=CN=C(N3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=CC=C1)C[NH+]2CCN(CC2)CC3=CN=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5/c1-17-6-5-9-22-20(17)16-26-12-10-25(11-13-26)15-19-14-23-21(24-19)18-7-3-2-4-8-18/h2-9,14H,10-13,15-16H2,1H3,(H,23,24)/p+1