ethyl (5Z)-2,4-dimethyl-5-[[3-(1,2-oxazol-5-yl)-5-oxidanylidene-1,2-dihydropyrazol-4-yl]methylidene]pyrrole-3-carboxylate

Systemtic Name: ethyl (5Z)-2,4-dimethyl-5-[[3-(1,2-oxazol-5-yl)-5-oxidanylidene-1,2-dihydropyrazol-4-yl]methylidene]pyrrole-3-carboxylate Openeye Name: ethyl (5Z)-5-[(3-isoxazol-5-yl-5-oxo-1,2-dihydropyrazol-4-yl)methylene]-2,4-dimethyl-pyrrole-3-carboxylate CAS Name: (5Z)-5-[[3-(5-isoxazolyl)-5-oxo-1,2-dihydropyrazol-4-yl]methylidene]-2,4-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2,4-dimethyl-5-[[3-(1,2-oxazol-5-yl)-5-oxo-1,2-dihydropyrazol-4-yl]methylidene]pyrrole-3-carboxylate Traditional Name: (5Z)-5-[(3-isoxazol-5-yl-5-keto-3-pyrazolin-4-yl)methylene]-2,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C16H16N4O4 MolecularWeight: 328.32264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC2=C(NNC2=O)C3=CC=NO3)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(/C(=C/C2=C(NNC2=O)C3=CC=NO3)/N=C1C)C

InChI

InChI=1S/C16H16N4O4/c1-4-23-16(22)13-8(2)11(18-9(13)3)7-10-14(19-20-15(10)21)12-5-6-17-24-12/h5-7H,4H2,1-3H3,(H2,19,20,21)/b11-7-