2-(furan-2-yl)ethyl-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methyl]azanium

Systemtic Name: 2-(furan-2-yl)ethyl-[[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]methyl]azanium Openeye Name: 2-(2-furyl)ethyl-[[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyl]ammonium CAS Name: 2-(2-furanyl)ethyl-[[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]methyl]ammonium IUPAC Name: 2-(furan-2-yl)ethyl-[[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]methyl]azanium Traditional Name: 2-(2-furyl)ethyl-[[1-phenyl-3-(p-tolyl)pyrazol-4-yl]methyl]ammonium Formula: C23H24N3O+ MolecularWeight: 358.45616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C[NH2+]CCC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O/c1-18-9-11-19(12-10-18)23-20(16-24-14-13-22-8-5-15-27-22)17-26(25-23)21-6-3-2-4-7-21/h2-12,15,17,24H,13-14,16H2,1H3/p+1