[5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-[[(2R)-5-oxidanylidenepyrrolidin-2-yl]methyl]-propan-2-yl-azanium

Systemtic Name: [5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-[[(2R)-5-oxidanylidenepyrrolidin-2-yl]methyl]-propan-2-yl-azanium Openeye Name: [5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-isopropyl-[[(2R)-5-oxopyrrolidin-2-yl]methyl]ammonium CAS Name: [5-(2-benzofuranyl)-1H-pyrazol-4-yl]methyl-[[(2R)-5-oxo-2-pyrrolidinyl]methyl]-propan-2-ylammonium IUPAC Name: [5-(1-benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-[[(2R)-5-oxopyrrolidin-2-yl]methyl]-propan-2-ylazanium Traditional Name: [5-(benzofuran-2-yl)-1H-pyrazol-4-yl]methyl-isopropyl-[[(2R)-5-ketopyrrolidin-2-yl]methyl]ammonium Formula: C20H25N4O2+ MolecularWeight: 353.4381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1CCC(=O)N1)CC2=C(NN=C2)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC(C)[NH+](C[C@H]1CCC(=O)N1)CC2=C(NN=C2)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C20H24N4O2/c1-13(2)24(12-16-7-8-19(25)22-16)11-15-10-21-23-20(15)18-9-14-5-3-4-6-17(14)26-18/h3-6,9-10,13,16H,7-8,11-12H2,1-2H3,(H,21,23)(H,22,25)/p+1/t16-/m1/s1