methyl 2-[5-[(E)-(5-oxidanylidene-1,3-diphenyl-pyrazol-4-ylidene)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 2-[5-[(E)-(5-oxidanylidene-1,3-diphenyl-pyrazol-4-ylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 2-[5-[(E)-(5-oxo-1,3-diphenyl-pyrazol-4-ylidene)methyl]-2-furyl]benzoate CAS Name: 2-[5-[(E)-(5-oxo-1,3-diphenyl-4-pyrazolylidene)methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 2-[5-[(E)-(5-oxo-1,3-diphenylpyrazol-4-ylidene)methyl]furan-2-yl]benzoate Traditional Name: 2-[5-[(E)-(5-keto-1,3-diphenyl-2-pyrazolin-4-ylidene)methyl]-2-furyl]benzoic acid methyl ester Formula: C28H20N2O4 MolecularWeight: 448.4694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2=CC=C(O2)C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2=CC=C(O2)/C=C/3\C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H20N2O4/c1-33-28(32)23-15-9-8-14-22(23)25-17-16-21(34-25)18-24-26(19-10-4-2-5-11-19)29-30(27(24)31)20-12-6-3-7-13-20/h2-18H,1H3/b24-18+