1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Formula: C22H29N6O+ MolecularWeight: 393.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=NN4)C

Isomeric SMILES

CCN1C(=C(C=N1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=NN4)C

InChI

InChI=1S/C22H28N6O/c1-3-28-16(2)19(14-24-28)15-27-11-8-17(9-12-27)22(29)25-20-6-4-5-18(13-20)21-7-10-23-26-21/h4-7,10,13-14,17H,3,8-9,11-12,15H2,1-2H3,(H,23,26)(H,25,29)/p+1