3,5-dimethyl-1-phenyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-1-phenyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]pyrazole-4-carboxamide Openeye Name: 3,5-dimethyl-1-phenyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]pyrazole-4-carboxamide CAS Name: 3,5-dimethyl-1-phenyl-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 3,5-dimethyl-1-phenyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]pyrazole-4-carboxamide Traditional Name: 3,5-dimethyl-1-phenyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]pyrazole-4-carboxamide Formula: C24H35N4O+ MolecularWeight: 395.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC3(CCCCC3)[NH+]4CCCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC3(CCCCC3)[NH+]4CCCCC4

InChI

InChI=1S/C24H34N4O/c1-19-22(20(2)28(26-19)21-12-6-3-7-13-21)23(29)25-18-24(14-8-4-9-15-24)27-16-10-5-11-17-27/h3,6-7,12-13H,4-5,8-11,14-18H2,1-2H3,(H,25,29)/p+1