(2R)-2-(furan-2-yl)-N-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine

Systemtic Name: (2R)-2-(furan-2-yl)-N-[(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine Openeye Name: (2R)-2-(2-furyl)-N-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamine CAS Name: (2R)-2-(2-furanyl)-N-[[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methyl]-2-(1-pyrrolidin-1-iumyl)ethanamine IUPAC Name: (2R)-2-(furan-2-yl)-N-[(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methyl]-2-pyrrolidin-1-ium-1-ylethanamine Traditional Name: [(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-[[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyl]amine Formula: C25H28N5O+ MolecularWeight: 414.52272

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNCC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C5=CC=CO5

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNCC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C5=CC=CO5

InChI

InChI=1S/C25H27N5O/c1-2-9-22(10-3-1)30-19-21(25(28-30)20-8-6-12-26-16-20)17-27-18-23(24-11-7-15-31-24)29-13-4-5-14-29/h1-3,6-12,15-16,19,23,27H,4-5,13-14,17-18H2/p+1/t23-/m1/s1