2-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]ethanoic acid

Systemtic Name: 2-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]ethanoic acid Openeye Name: 2-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methylamino]acetic acid CAS Name: 2-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methylamino]acetic acid IUPAC Name: 2-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylamino]acetic acid Traditional Name: 2-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methylamino]acetic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNCC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1=CNCC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C13H13N3O3/c1-9-11(7-14-8-12(17)18)13(19)16(15-9)10-5-3-2-4-6-10/h2-7,14H,8H2,1H3,(H,17,18)