ethyl 4-[5-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[[(2-chloranylpyridin-3-yl)carbonylhydrazinylidene]methyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[[(2-chloropyridine-3-carbonyl)hydrazono]methyl]-2-furyl]benzoate CAS Name: 4-[5-[[[(2-chloro-3-pyridinyl)-oxomethyl]hydrazinylidene]methyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[[(2-chloropyridine-3-carbonyl)hydrazinylidene]methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[[(2-chloronicotinoyl)hydrazono]methyl]-2-furyl]benzoic acid ethyl ester Formula: C20H16ClN3O4 MolecularWeight: 397.81174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=C(N=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C20H16ClN3O4/c1-2-27-20(26)14-7-5-13(6-8-14)17-10-9-15(28-17)12-23-24-19(25)16-4-3-11-22-18(16)21/h3-12H,2H2,1H3,(H,24,25)