4-bromanyl-2-methyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-(1-methyl-4-piperidin-1-iumyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-3-carboxamide Traditional Name: 4-bromo-2-methyl-N-(1-methylpiperidin-1-ium-4-yl)pyrazole-3-carboxamide Formula: C11H18BrN4O+ MolecularWeight: 302.19082

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2=C(C=NN2C)Br

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)C2=C(C=NN2C)Br

InChI

InChI=1S/C11H17BrN4O/c1-15-5-3-8(4-6-15)14-11(17)10-9(12)7-13-16(10)2/h7-8H,3-6H2,1-2H3,(H,14,17)/p+1