2-[2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl]-2-oxidanyl-ethanoate

Systemtic Name: 2-[2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl]-2-oxidanyl-ethanoate Openeye Name: 2-[2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl]-2-hydroxy-acetate CAS Name: 2-[2,6-dimethyl-4-[(1-phenyl-3-pyrazolyl)amino]phenyl]-2-hydroxyacetate IUPAC Name: 2-[2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl]-2-hydroxyacetate Traditional Name: 2-[2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl]-2-hydroxy-acetate Formula: C19H18N3O3- MolecularWeight: 336.36452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(C(=O)[O-])O)C)NC2=NN(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1C(C(=O)[O-])O)C)NC2=NN(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O3/c1-12-10-14(11-13(2)17(12)18(23)19(24)25)20-16-8-9-22(21-16)15-6-4-3-5-7-15/h3-11,18,23H,1-2H3,(H,20,21)(H,24,25)/p-1