ethyl 2-(5-chloranyl-2-nitro-phenyl)-5-(furan-3-yl)-1,2,4-triazole-3-carboxylate

Systemtic Name: ethyl 2-(5-chloranyl-2-nitro-phenyl)-5-(furan-3-yl)-1,2,4-triazole-3-carboxylate Openeye Name: ethyl 2-(5-chloro-2-nitro-phenyl)-5-(3-furyl)-1,2,4-triazole-3-carboxylate CAS Name: 2-(5-chloro-2-nitrophenyl)-5-(3-furanyl)-1,2,4-triazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(5-chloro-2-nitrophenyl)-5-(furan-3-yl)-1,2,4-triazole-3-carboxylate Traditional Name: 2-(5-chloro-2-nitro-phenyl)-5-(3-furyl)-1,2,4-triazole-3-carboxylic acid ethyl ester Formula: C15H11ClN4O5 MolecularWeight: 362.72464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=NN1C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C3=COC=C3

Isomeric SMILES

CCOC(=O)C1=NC(=NN1C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C3=COC=C3

InChI

InChI=1S/C15H11ClN4O5/c1-2-25-15(21)14-17-13(9-5-6-24-8-9)18-19(14)12-7-10(16)3-4-11(12)20(22)23/h3-8H,2H2,1H3