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

Systemtic Name: 3-[5-[(E)-[1-(4-ethylphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]furan-2-yl]benzoate Openeye Name: 3-[5-[(E)-[1-(4-ethylphenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]-2-furyl]benzoate CAS Name: 3-[5-[(E)-[1-(4-ethylphenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]-2-furanyl]benzoate IUPAC Name: 3-[5-[(E)-[1-(4-ethylphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]furan-2-yl]benzoate Traditional Name: 3-[5-[(E)-[1-(4-ethylphenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]-2-furyl]benzoate Formula: C24H19N2O4- MolecularWeight: 399.41866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(=O)[O-])C(=N2)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC(=CC=C4)C(=O)[O-])/C(=N2)C

InChI

InChI=1S/C24H20N2O4/c1-3-16-7-9-19(10-8-16)26-23(27)21(15(2)25-26)14-20-11-12-22(30-20)17-5-4-6-18(13-17)24(28)29/h4-14H,3H2,1-2H3,(H,28,29)/p-1/b21-14+