methyl (2R)-2-(3,5-dimethylpyrazol-1-yl)-4-(4-methylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: methyl (2R)-2-(3,5-dimethylpyrazol-1-yl)-4-(4-methylphenyl)-4-oxidanylidene-butanoate Openeye Name: methyl (2R)-2-(3,5-dimethylpyrazol-1-yl)-4-oxo-4-(p-tolyl)butanoate CAS Name: (2R)-2-(3,5-dimethyl-1-pyrazolyl)-4-(4-methylphenyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl (2R)-2-(3,5-dimethylpyrazol-1-yl)-4-(4-methylphenyl)-4-oxobutanoate Traditional Name: (2R)-2-(3,5-dimethylpyrazol-1-yl)-4-keto-4-(p-tolyl)butyric acid methyl ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CC(C(=O)OC)N2C(=CC(=N2)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[C@H](C(=O)OC)N2C(=CC(=N2)C)C

InChI

InChI=1S/C17H20N2O3/c1-11-5-7-14(8-6-11)16(20)10-15(17(21)22-4)19-13(3)9-12(2)18-19/h5-9,15H,10H2,1-4H3/t15-/m1/s1