methyl 4-chloranyl-3-[5-[(E)-(2-phenylethanoylhydrazinylidene)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 4-chloranyl-3-[5-[(E)-(2-phenylethanoylhydrazinylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 4-chloro-3-[5-[(E)-[(2-phenylacetyl)hydrazono]methyl]-2-furyl]benzoate CAS Name: 4-chloro-3-[5-[(E)-[(1-oxo-2-phenylethyl)hydrazinylidene]methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[5-[(E)-[(2-phenylacetyl)hydrazinylidene]methyl]furan-2-yl]benzoate Traditional Name: 4-chloro-3-[5-[(E)-[(2-phenylacetyl)hydrazono]methyl]-2-furyl]benzoic acid methyl ester Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)C2=CC=C(O2)C=NNC(=O)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)C2=CC=C(O2)/C=N/NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H17ClN2O4/c1-27-21(26)15-7-9-18(22)17(12-15)19-10-8-16(28-19)13-23-24-20(25)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3,(H,24,25)/b23-13+