2-(5-methyl-3-phenyl-pyrazol-1-yl)butanedioic acid

Systemtic Name: 2-(5-methyl-3-phenyl-pyrazol-1-yl)butanedioic acid Openeye Name: 2-(5-methyl-3-phenyl-pyrazol-1-yl)butanedioic acid CAS Name: 2-(5-methyl-3-phenyl-1-pyrazolyl)butanedioic acid IUPAC Name: 2-(5-methyl-3-phenylpyrazol-1-yl)butanedioic acid Traditional Name: 2-(5-methyl-3-phenyl-pyrazol-1-yl)succinic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

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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(=NN1C(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)