ethyl (5E)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-4-oxidanylidene-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl (5E)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-4-oxidanylidene-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl (5E)-5-(1,3-benzodioxol-5-ylhydrazono)-4-oxo-1-phenyl-pyrazole-3-carboxylate CAS Name: (5E)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-4-oxo-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-(1,3-benzodioxol-5-ylhydrazinylidene)-4-oxo-1-phenylpyrazole-3-carboxylate Traditional Name: (5E)-5-(1,3-benzodioxol-5-ylhydrazono)-4-keto-1-phenyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C19H16N4O5 MolecularWeight: 380.35414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=NNC2=CC3=C(C=C2)OCO3)C1=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=NN(/C(=N/NC2=CC3=C(C=C2)OCO3)/C1=O)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O5/c1-2-26-19(25)16-17(24)18(23(22-16)13-6-4-3-5-7-13)21-20-12-8-9-14-15(10-12)28-11-27-14/h3-10,20H,2,11H2,1H3/b21-18+