N-cyclopropyl-1-[1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]carbonyl]piperidin-4-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-cyclopropyl-1-[1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]carbonyl]piperidin-4-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-cyclopropyl-1-[1-(5-isobutyl-1H-pyrazole-3-carbonyl)-4-piperidyl]piperidin-1-ium-4-carboxamide CAS Name: N-cyclopropyl-1-[1-[[5-(2-methylpropyl)-1H-pyrazol-3-yl]-oxomethyl]-4-piperidinyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-cyclopropyl-1-[1-[5-(2-methylpropyl)-1H-pyrazole-3-carbonyl]piperidin-4-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-cyclopropyl-1-[1-(5-isobutyl-1H-pyrazole-3-carbonyl)-4-piperidyl]piperidin-1-ium-4-carboxamide Formula: C22H36N5O2+ MolecularWeight: 402.55354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1)C(=O)N2CCC(CC2)[NH+]3CCC(CC3)C(=O)NC4CC4

Isomeric SMILES

CC(C)CC1=CC(=NN1)C(=O)N2CCC(CC2)[NH+]3CCC(CC3)C(=O)NC4CC4

InChI

InChI=1S/C22H35N5O2/c1-15(2)13-18-14-20(25-24-18)22(29)27-11-7-19(8-12-27)26-9-5-16(6-10-26)21(28)23-17-3-4-17/h14-17,19H,3-13H2,1-2H3,(H,23,28)(H,24,25)/p+1