ethyl 3-[diethoxyphosphoryl(phenyl)methyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 3-[diethoxyphosphoryl(phenyl)methyl]-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 3-[diethoxyphosphoryl(phenyl)methyl]triazole-4-carboxylate CAS Name: 3-[diethoxyphosphoryl(phenyl)methyl]-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[diethoxyphosphoryl(phenyl)methyl]triazole-4-carboxylate Traditional Name: 3-[diethoxyphosphoryl(phenyl)methyl]triazole-4-carboxylic acid ethyl ester Formula: C16H22N3O5P MolecularWeight: 367.336741

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=NN1C(C2=CC=CC=C2)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C1=CN=NN1C(C2=CC=CC=C2)P(=O)(OCC)OCC

InChI

InChI=1S/C16H22N3O5P/c1-4-22-16(20)14-12-17-18-19(14)15(13-10-8-7-9-11-13)25(21,23-5-2)24-6-3/h7-12,15H,4-6H2,1-3H3