4-(4-bromanylpyrazol-1-yl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 4-(4-bromanylpyrazol-1-yl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Openeye Name: 4-(4-bromopyrazol-1-yl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide CAS Name: 4-(4-bromo-1-pyrazolyl)-N-[3-(1-piperidin-1-iumyl)propyl]benzamide IUPAC Name: 4-(4-bromopyrazol-1-yl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Traditional Name: 4-(4-bromopyrazol-1-yl)-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Formula: C18H24BrN4O+ MolecularWeight: 392.31336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)C2=CC=C(C=C2)N3C=C(C=N3)Br

InChI

InChI=1S/C18H23BrN4O/c19-16-13-21-23(14-16)17-7-5-15(6-8-17)18(24)20-9-4-12-22-10-2-1-3-11-22/h5-8,13-14H,1-4,9-12H2,(H,20,24)/p+1