[(1R)-1-(2-methoxyphenyl)-2-[(1-phenylpyrazol-4-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(2-methoxyphenyl)-2-[(1-phenylpyrazol-4-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(2-methoxyphenyl)-2-[(1-phenylpyrazole-4-carbonyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(2-methoxyphenyl)-2-[[oxo-(1-phenyl-4-pyrazolyl)methyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(2-methoxyphenyl)-2-[(1-phenylpyrazole-4-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1R)-1-(2-methoxyphenyl)-2-[(1-phenylpyrazole-4-carbonyl)amino]ethyl]-dimethyl-ammonium Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CN(N=C1)C2=CC=CC=C2)C3=CC=CC=C3OC

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)C1=CN(N=C1)C2=CC=CC=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H24N4O2/c1-24(2)19(18-11-7-8-12-20(18)27-3)14-22-21(26)16-13-23-25(15-16)17-9-5-4-6-10-17/h4-13,15,19H,14H2,1-3H3,(H,22,26)/p+1/t19-/m0/s1