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

Systemtic Name: [3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-[(2R)-4-pyrazol-1-ylbutan-2-yl]azanium Openeye Name: [3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-[(1R)-1-methyl-3-pyrazol-1-yl-propyl]ammonium CAS Name: [3-(3-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl-[(2R)-4-(1-pyrazolyl)butan-2-yl]ammonium IUPAC Name: [3-(3-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl-[(2R)-4-pyrazol-1-ylbutan-2-yl]azanium Traditional Name: [3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl-[(1R)-1-methyl-3-pyrazol-1-yl-propyl]ammonium Formula: C24H28N5O+ MolecularWeight: 402.51202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=CC=N1)[NH2+]CC2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CCN1C=CC=N1)[NH2+]CC2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H27N5O/c1-19(12-15-28-14-7-13-26-28)25-17-21-18-29(22-9-4-3-5-10-22)27-24(21)20-8-6-11-23(16-20)30-2/h3-11,13-14,16,18-19,25H,12,15,17H2,1-2H3/p+1/t19-/m1/s1