[(2R)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium

Systemtic Name: [(2R)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-azanium Openeye Name: [(1R)-2-(dimethylamino)-1-methyl-2-oxo-ethyl]-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium CAS Name: [(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-[(1,3-diphenyl-4-pyrazolyl)methyl]-methylammonium IUPAC Name: [(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-[(1,3-diphenylpyrazol-4-yl)methyl]-methylazanium Traditional Name: [(1R)-2-(dimethylamino)-2-keto-1-methyl-ethyl]-[(1,3-diphenylpyrazol-4-yl)methyl]-methyl-ammonium Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)[NH+](C)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)N(C)C)[NH+](C)CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O/c1-17(22(27)24(2)3)25(4)15-19-16-26(20-13-9-6-10-14-20)23-21(19)18-11-7-5-8-12-18/h5-14,16-17H,15H2,1-4H3/p+1/t17-/m1/s1