[3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-methyl-(1,2-oxazol-5-ylmethyl)azanium

Systemtic Name: [3-(1-benzofuran-2-yl)-1-(phenylmethyl)pyrazol-4-yl]methyl-methyl-(1,2-oxazol-5-ylmethyl)azanium Openeye Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-(isoxazol-5-ylmethyl)-methyl-ammonium CAS Name: [3-(2-benzofuranyl)-1-(phenylmethyl)-4-pyrazolyl]methyl-(5-isoxazolylmethyl)-methylammonium IUPAC Name: [3-(1-benzofuran-2-yl)-1-benzylpyrazol-4-yl]methyl-methyl-(1,2-oxazol-5-ylmethyl)azanium Traditional Name: [3-(benzofuran-2-yl)-1-benzyl-pyrazol-4-yl]methyl-(isoxazol-5-ylmethyl)-methyl-ammonium Formula: C24H23N4O2+ MolecularWeight: 399.46502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=NO1)CC2=CN(N=C2C3=CC4=CC=CC=C4O3)CC5=CC=CC=C5

Isomeric SMILES

C[NH+](CC1=CC=NO1)CC2=CN(N=C2C3=CC4=CC=CC=C4O3)CC5=CC=CC=C5

InChI

InChI=1S/C24H22N4O2/c1-27(17-21-11-12-25-30-21)15-20-16-28(14-18-7-3-2-4-8-18)26-24(20)23-13-19-9-5-6-10-22(19)29-23/h2-13,16H,14-15,17H2,1H3/p+1