4-phenyl-N-[2-[1-[(2R)-1-pyridin-2-ylpropan-2-yl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide

Systemtic Name: 4-phenyl-N-[2-[1-[(2R)-1-pyridin-2-ylpropan-2-yl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Openeye Name: N-[2-[1-[(1R)-1-methyl-2-(2-pyridyl)ethyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-4-phenyl-butanamide CAS Name: 4-phenyl-N-[2-[1-[(2R)-1-(2-pyridinyl)propan-2-yl]-4-piperidin-1-iumyl]-3-pyrazolyl]butanamide IUPAC Name: 4-phenyl-N-[2-[1-[(2R)-1-pyridin-2-ylpropan-2-yl]piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Traditional Name: N-[2-[1-[(1R)-1-methyl-2-(2-pyridyl)ethyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-4-phenyl-butyramide Formula: C26H34N5O+ MolecularWeight: 432.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=N1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C[C@H](CC1=CC=CC=N1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H33N5O/c1-21(20-23-11-5-6-16-27-23)30-18-14-24(15-19-30)31-25(13-17-28-31)29-26(32)12-7-10-22-8-3-2-4-9-22/h2-6,8-9,11,13,16-17,21,24H,7,10,12,14-15,18-20H2,1H3,(H,29,32)/p+1/t21-/m1/s1