ethyl 5-[5-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]furan-2-yl]-2-chloranyl-benzoate

Systemtic Name: ethyl 5-[5-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]furan-2-yl]-2-chloranyl-benzoate Openeye Name: ethyl 5-[5-[(E)-(1H-benzimidazol-2-ylhydrazono)methyl]-2-furyl]-2-chloro-benzoate CAS Name: 5-[5-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]-2-furanyl]-2-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 5-[5-[(E)-(1H-benzimidazol-2-ylhydrazinylidene)methyl]furan-2-yl]-2-chlorobenzoate Traditional Name: 5-[5-[(E)-(1H-benzimidazol-2-ylhydrazono)methyl]-2-furyl]-2-chloro-benzoic acid ethyl ester Formula: C21H17ClN4O3 MolecularWeight: 408.83768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=NNC3=NC4=CC=CC=C4N3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)/C=N/NC3=NC4=CC=CC=C4N3)Cl

InChI

InChI=1S/C21H17ClN4O3/c1-2-28-20(27)15-11-13(7-9-16(15)22)19-10-8-14(29-19)12-23-26-21-24-17-5-3-4-6-18(17)25-21/h3-12H,2H2,1H3,(H2,24,25,26)/b23-12+