methyl-[(3-phenyl-1H-pyrazol-5-yl)methyl]-[[3-(1-pyridin-4-ylcarbonylpiperidin-4-yl)oxyphenyl]methyl]azanium

Systemtic Name: methyl-[(3-phenyl-1H-pyrazol-5-yl)methyl]-[[3-(1-pyridin-4-ylcarbonylpiperidin-4-yl)oxyphenyl]methyl]azanium Openeye Name: methyl-[(3-phenyl-1H-pyrazol-5-yl)methyl]-[[3-[[1-(pyridine-4-carbonyl)-4-piperidyl]oxy]phenyl]methyl]ammonium CAS Name: methyl-[[3-[[1-[oxo(pyridin-4-yl)methyl]-4-piperidinyl]oxy]phenyl]methyl]-[(3-phenyl-1H-pyrazol-5-yl)methyl]ammonium IUPAC Name: methyl-[(3-phenyl-1H-pyrazol-5-yl)methyl]-[[3-[1-(pyridine-4-carbonyl)piperidin-4-yl]oxyphenyl]methyl]azanium Traditional Name: [3-[(1-isonicotinoyl-4-piperidyl)oxy]benzyl]-methyl-[(3-phenyl-1H-pyrazol-5-yl)methyl]ammonium Formula: C29H32N5O2+ MolecularWeight: 482.59668

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC2CCN(CC2)C(=O)C3=CC=NC=C3)CC4=CC(=NN4)C5=CC=CC=C5

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC2CCN(CC2)C(=O)C3=CC=NC=C3)CC4=CC(=NN4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O2/c1-33(21-25-19-28(32-31-25)23-7-3-2-4-8-23)20-22-6-5-9-27(18-22)36-26-12-16-34(17-13-26)29(35)24-10-14-30-15-11-24/h2-11,14-15,18-19,26H,12-13,16-17,20-21H2,1H3,(H,31,32)/p+1