ethyl 4-[4-(4-imidazol-1-ylphenyl)carbonyl-1,2,3-triazol-1-yl]benzoate

Systemtic Name: ethyl 4-[4-(4-imidazol-1-ylphenyl)carbonyl-1,2,3-triazol-1-yl]benzoate Openeye Name: ethyl 4-[4-(4-imidazol-1-ylbenzoyl)triazol-1-yl]benzoate CAS Name: 4-[4-[[4-(1-imidazolyl)phenyl]-oxomethyl]-1-triazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-imidazol-1-ylbenzoyl)triazol-1-yl]benzoate Traditional Name: 4-[4-(4-imidazol-1-ylbenzoyl)triazol-1-yl]benzoic acid ethyl ester Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C=C(N=N2)C(=O)C3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C=C(N=N2)C(=O)C3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H17N5O3/c1-2-29-21(28)16-5-9-18(10-6-16)26-13-19(23-24-26)20(27)15-3-7-17(8-4-15)25-12-11-22-14-25/h3-14H,2H2,1H3