(E,2Z)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-hydroxyimino-but-3-enoic acid

Systemtic Name: (E,2Z)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-hydroxyimino-but-3-enoic acid Openeye Name: (E,2Z)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-hydroxyimino-but-3-enoic acid CAS Name: (E,2Z)-4-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-hydroxyimino-3-butenoic acid IUPAC Name: (E,2Z)-4-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-hydroxyiminobut-3-enoic acid Traditional Name: (E,2Z)-4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-hydroximino-but-3-enoic acid Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=CC(=NO)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=C/C(=N/O)/C(=O)O

InChI

InChI=1S/C15H15N3O3/c1-10-13(8-9-14(17-21)15(19)20)11(2)18(16-10)12-6-4-3-5-7-12/h3-9,21H,1-2H3,(H,19,20)/b9-8+,17-14-