[(1S)-1-(4-methoxyphenyl)-2-[(4-pyrazol-1-ylphenyl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-methoxyphenyl)-2-[(4-pyrazol-1-ylphenyl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-methoxyphenyl)-2-[(4-pyrazol-1-ylbenzoyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-methoxyphenyl)-2-[[oxo-[4-(1-pyrazolyl)phenyl]methyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-methoxyphenyl)-2-[(4-pyrazol-1-ylbenzoyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-methoxyphenyl)-2-[(4-pyrazol-1-ylbenzoyl)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=CC=C(C=C1)N2C=CC=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC=C(C=C1)N2C=CC=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N4O2/c1-24(2)20(16-7-11-19(27-3)12-8-16)15-22-21(26)17-5-9-18(10-6-17)25-14-4-13-23-25/h4-14,20H,15H2,1-3H3,(H,22,26)/p+1/t20-/m1/s1