methyl (2R)-4-(4-methylphenyl)-4-oxidanylidene-2-pyrazol-1-yl-butanoate

Systemtic Name: methyl (2R)-4-(4-methylphenyl)-4-oxidanylidene-2-pyrazol-1-yl-butanoate Openeye Name: methyl (2R)-4-oxo-4-(p-tolyl)-2-pyrazol-1-yl-butanoate CAS Name: (2R)-4-(4-methylphenyl)-4-oxo-2-(1-pyrazolyl)butanoic acid methyl ester IUPAC Name: methyl (2R)-4-(4-methylphenyl)-4-oxo-2-pyrazol-1-ylbutanoate Traditional Name: (2R)-4-keto-4-(p-tolyl)-2-pyrazol-1-yl-butyric acid methyl ester Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O3/c1-11-4-6-12(7-5-11)14(18)10-13(15(19)20-2)17-9-3-8-16-17/h3-9,13H,10H2,1-2H3/t13-/m1/s1