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

Systemtic Name: methyl 2-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylamino]ethanoate Openeye Name: methyl 2-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methylamino]acetate CAS Name: 2-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylamino]acetate Traditional Name: 2-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methylamino]acetic acid methyl ester Formula: C14H15N3O3 MolecularWeight: 273.2872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3/c1-10-12(8-15-9-13(18)20-2)14(19)17(16-10)11-6-4-3-5-7-11/h3-8,15H,9H2,1-2H3