2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-2-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]acetamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]acetamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetamide Formula: C24H36N5O2+ MolecularWeight: 426.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H35N5O2/c1-17(2)15-29-19(4)22(18(3)27-29)14-23(30)25-21-10-12-28(13-11-21)16-24(31)26-20-8-6-5-7-9-20/h5-9,17,21H,10-16H2,1-4H3,(H,25,30)(H,26,31)/p+1