ethyl 5-(4-chlorophenyl)-2-phenyl-4-(1,2,4-triazol-1-yl)furan-3-carboxylate

Systemtic Name: ethyl 5-(4-chlorophenyl)-2-phenyl-4-(1,2,4-triazol-1-yl)furan-3-carboxylate Openeye Name: ethyl 5-(4-chlorophenyl)-2-phenyl-4-(1,2,4-triazol-1-yl)furan-3-carboxylate CAS Name: 5-(4-chlorophenyl)-2-phenyl-4-(1,2,4-triazol-1-yl)-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenyl)-2-phenyl-4-(1,2,4-triazol-1-yl)furan-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-2-phenyl-4-(1,2,4-triazol-1-yl)furan-3-carboxylic acid ethyl ester Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1N2C=NC=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1N2C=NC=N2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H16ClN3O3/c1-2-27-21(26)17-18(25-13-23-12-24-25)20(15-8-10-16(22)11-9-15)28-19(17)14-6-4-3-5-7-14/h3-13H,2H2,1H3