[(1S)-2-[(4-methoxy-1-phenyl-pyrazol-3-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-methoxy-1-phenyl-pyrazol-3-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-methoxy-1-phenyl-pyrazole-3-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-methoxy-1-phenyl-3-pyrazolyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-methoxy-1-phenylpyrazole-3-carbonyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-methoxy-1-phenyl-pyrazole-3-carbonyl)amino]-1-phenyl-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=NN(C=C1OC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=NN(C=C1OC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O2/c1-24(2)18(16-10-6-4-7-11-16)14-22-21(26)20-19(27-3)15-25(23-20)17-12-8-5-9-13-17/h4-13,15,18H,14H2,1-3H3,(H,22,26)/p+1/t18-/m1/s1