(5S)-N,1-dimethyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: (5S)-N,1-dimethyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: (5S)-N,1-dimethyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: (5S)-N,1-dimethyl-5-(1-piperidin-1-iumyl)-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: (5S)-N,1-dimethyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: (5S)-N,1-dimethyl-5-piperidin-1-ium-1-yl-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C15H25N4O+ MolecularWeight: 277.3852

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C2=C1CC(CC2)[NH+]3CCCCC3)C

Isomeric SMILES

CNC(=O)C1=NN(C2=C1C[C@H](CC2)[NH+]3CCCCC3)C

InChI

InChI=1S/C15H24N4O/c1-16-15(20)14-12-10-11(19-8-4-3-5-9-19)6-7-13(12)18(2)17-14/h11H,3-10H2,1-2H3,(H,16,20)/p+1/t11-/m0/s1