[(1R)-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylamino]-1-(furan-2-yl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylamino]-1-(furan-2-yl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)amino]-1-(2-furyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(3,5-dimethyl-1-phenyl-4-pyrazolyl)-oxomethyl]amino]-1-(2-furanyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(3,5-dimethyl-1-phenylpyrazole-4-carbonyl)amino]-1-(furan-2-yl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-[(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)amino]-1-(2-furyl)ethyl]-dimethyl-ammonium Formula: C20H25N4O2+ MolecularWeight: 353.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NCC(C3=CC=CO3)[NH+](C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC[C@H](C3=CC=CO3)[NH+](C)C

InChI

InChI=1S/C20H24N4O2/c1-14-19(15(2)24(22-14)16-9-6-5-7-10-16)20(25)21-13-17(23(3)4)18-11-8-12-26-18/h5-12,17H,13H2,1-4H3,(H,21,25)/p+1/t17-/m1/s1