(2R)-2-(5-methyl-3-phenyl-pyrazol-1-yl)butanedioate

Systemtic Name: (2R)-2-(5-methyl-3-phenyl-pyrazol-1-yl)butanedioate Openeye Name: (2R)-2-(5-methyl-3-phenyl-pyrazol-1-yl)butanedioate CAS Name: (2R)-2-(5-methyl-3-phenyl-1-pyrazolyl)butanedioate IUPAC Name: (2R)-2-(5-methyl-3-phenylpyrazol-1-yl)butanedioate Traditional Name: (2R)-2-(5-methyl-3-phenyl-pyrazol-1-yl)succinate Formula: C14H12N2O4-2 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(CC(=O)[O-])C(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NN1[C@H](CC(=O)[O-])C(=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C14H14N2O4/c1-9-7-11(10-5-3-2-4-6-10)15-16(9)12(14(19)20)8-13(17)18/h2-7,12H,8H2,1H3,(H,17,18)(H,19,20)/p-2/t12-/m1/s1