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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC=C1C(=NNC1=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CNC=C1C(=NNC1=O)C2=CC=CC=C2

InChI

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