N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-pyrazol-1-yl-benzamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-pyrazol-1-yl-benzamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-pyrazol-1-yl-benzamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-4-(1-pyrazolyl)benzamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-pyrazol-1-ylbenzamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-4-pyrazol-1-yl-benzamide Formula: C22H26N5O+ MolecularWeight: 376.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O/c28-22(19-7-9-21(10-8-19)27-13-4-11-24-27)23-12-14-25-15-17-26(18-16-25)20-5-2-1-3-6-20/h1-11,13H,12,14-18H2,(H,23,28)/p+1