(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 4-(3,5-dimethylpyrazol-1-yl)benzoate Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)N)C

InChI

InChI=1S/C20H19N3O3/c1-13-12-14(2)23(22-13)17-10-8-16(9-11-17)20(25)26-18(19(21)24)15-6-4-3-5-7-15/h3-12,18H,1-2H3,(H2,21,24)