(5-phenyl-1,2-oxazol-3-yl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)CN4C=NC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)CN4C=NC=N4

InChI

InChI=1S/C20H16N4O3/c25-20(17-8-6-15(7-9-17)11-24-14-21-13-22-24)26-12-18-10-19(27-23-18)16-4-2-1-3-5-16/h1-10,13-14H,11-12H2