[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-[[(2R)-5-oxidanylidenepyrrolidin-2-yl]methyl]-propan-2-yl-azanium

Systemtic Name: [3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-[[(2R)-5-oxidanylidenepyrrolidin-2-yl]methyl]-propan-2-yl-azanium Openeye Name: isopropyl-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-[[(2R)-5-oxopyrrolidin-2-yl]methyl]ammonium CAS Name: [3-(3-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-[[(2R)-5-oxo-2-pyrrolidinyl]methyl]-propan-2-ylammonium IUPAC Name: [3-(3-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl-[[(2R)-5-oxopyrrolidin-2-yl]methyl]-propan-2-ylazanium Traditional Name: isopropyl-[[(2R)-5-ketopyrrolidin-2-yl]methyl]-[[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]ammonium Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1CCC(=O)N1)CC2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC(C)[NH+](C[C@H]1CCC(=O)N1)CC2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2/c1-18(2)28(17-21-12-13-24(30)26-21)15-20-16-29(22-9-5-4-6-10-22)27-25(20)19-8-7-11-23(14-19)31-3/h4-11,14,16,18,21H,12-13,15,17H2,1-3H3,(H,26,30)/p+1/t21-/m1/s1