[(2R)-1-imidazol-1-yl-3,3-dimethyl-butan-2-yl]-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]azanium

Systemtic Name: [(2R)-1-imidazol-1-yl-3,3-dimethyl-butan-2-yl]-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]azanium Openeye Name: [(1R)-1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]ammonium CAS Name: [(2R)-1-(1-imidazolyl)-3,3-dimethylbutan-2-yl]-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]ammonium IUPAC Name: [(2R)-1-imidazol-1-yl-3,3-dimethylbutan-2-yl]-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]azanium Traditional Name: [(1R)-1-(imidazol-1-ylmethyl)-2,2-dimethyl-propyl]-[[5-(4-phenylphenyl)-1H-pyrazol-4-yl]methyl]ammonium Formula: C25H30N5+ MolecularWeight: 400.5392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=CN=C1)[NH2+]CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)[C@H](CN1C=CN=C1)[NH2+]CC2=C(NN=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N5/c1-25(2,3)23(17-30-14-13-26-18-30)27-15-22-16-28-29-24(22)21-11-9-20(10-12-21)19-7-5-4-6-8-19/h4-14,16,18,23,27H,15,17H2,1-3H3,(H,28,29)/p+1/t23-/m0/s1