4-chloranyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 4-chloranyl-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1H-pyrazole-5-carboxamide Openeye Name: 4-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1H-pyrazole-5-carboxamide CAS Name: 4-chloro-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-1H-pyrazole-5-carboxamide IUPAC Name: 4-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1H-pyrazole-5-carboxamide Formula: C15H19ClN5O+ MolecularWeight: 320.79726

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=NN3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(C=NN3)Cl

InChI

InChI=1S/C15H18ClN5O/c1-20-6-8-21(9-7-20)12-4-2-11(3-5-12)18-15(22)14-13(16)10-17-19-14/h2-5,10H,6-9H2,1H3,(H,17,19)(H,18,22)/p+1