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

Systemtic Name: dimethyl-[(1S)-1-phenyl-2-[(4-pyrazol-1-ylphenyl)carbonylamino]ethyl]azanium Openeye Name: dimethyl-[(1S)-1-phenyl-2-[(4-pyrazol-1-ylbenzoyl)amino]ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[oxo-[4-(1-pyrazolyl)phenyl]methyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-1-phenyl-2-[(4-pyrazol-1-ylbenzoyl)amino]ethyl]azanium Traditional Name: dimethyl-[(1S)-1-phenyl-2-[(4-pyrazol-1-ylbenzoyl)amino]ethyl]ammonium Formula: C20H23N4O+ MolecularWeight: 335.42282

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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=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O/c1-23(2)19(16-7-4-3-5-8-16)15-21-20(25)17-9-11-18(12-10-17)24-14-6-13-22-24/h3-14,19H,15H2,1-2H3,(H,21,25)/p+1/t19-/m1/s1