N-(4-methylpiperazin-4-ium-1-yl)-4-pyrazol-1-yl-benzamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-4-pyrazol-1-yl-benzamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-4-pyrazol-1-yl-benzamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-4-(1-pyrazolyl)benzamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-4-pyrazol-1-ylbenzamide Traditional Name: N-(4-methylpiperazin-4-ium-1-yl)-4-pyrazol-1-yl-benzamide Formula: C15H20N5O+ MolecularWeight: 286.3522

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C15H19N5O/c1-18-9-11-19(12-10-18)17-15(21)13-3-5-14(6-4-13)20-8-2-7-16-20/h2-8H,9-12H2,1H3,(H,17,21)/p+1