[(2R)-1-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]-3-methyl-butan-2-yl]-dimethyl-azanium

Systemtic Name: [(2R)-1-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]-3-methyl-butan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-1-[[[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]methyl]-2-methyl-propyl]-dimethyl-ammonium CAS Name: [(2R)-1-[[[5-(2-furanyl)-2-phenyl-3-pyrazolyl]-oxomethyl]amino]-3-methylbutan-2-yl]-dimethylammonium IUPAC Name: [(2R)-1-[[5-(furan-2-yl)-2-phenylpyrazole-3-carbonyl]amino]-3-methylbutan-2-yl]-dimethylazanium Traditional Name: [(1R)-1-[[[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]methyl]-2-methyl-propyl]-dimethyl-ammonium Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CO3)[NH+](C)C

Isomeric SMILES

CC(C)[C@H](CNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CO3)[NH+](C)C

InChI

InChI=1S/C21H26N4O2/c1-15(2)19(24(3)4)14-22-21(26)18-13-17(20-11-8-12-27-20)23-25(18)16-9-6-5-7-10-16/h5-13,15,19H,14H2,1-4H3,(H,22,26)/p+1/t19-/m0/s1