ethyl (2R)-2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: ethyl (2R)-2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]-4-oxidanylidene-4-phenyl-butanoate Openeye Name: ethyl (2R)-2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]-4-oxo-4-phenyl-butanoate CAS Name: (2R)-2-[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]-4-oxo-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]-4-oxo-4-phenylbutanoate Traditional Name: (2R)-2-[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]-4-keto-4-phenyl-butyric acid ethyl ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=CC=C1)CC(=O)N2C(=CC(=N2)C)C

Isomeric SMILES

CCOC(=O)[C@H](CC(=O)C1=CC=CC=C1)CC(=O)N2C(=CC(=N2)C)C

InChI

InChI=1S/C19H22N2O4/c1-4-25-19(24)16(11-17(22)15-8-6-5-7-9-15)12-18(23)21-14(3)10-13(2)20-21/h5-10,16H,4,11-12H2,1-3H3/t16-/m1/s1