[1-ethoxy-1-oxidanylidene-2-(4-phenoxyphenyl)propan-2-yl] 1,2,4-triazole-1-carboxylate

Systemtic Name: [1-ethoxy-1-oxidanylidene-2-(4-phenoxyphenyl)propan-2-yl] 1,2,4-triazole-1-carboxylate Openeye Name: [2-ethoxy-1-methyl-2-oxo-1-(4-phenoxyphenyl)ethyl] 1,2,4-triazole-1-carboxylate CAS Name: 1,2,4-triazole-1-carboxylic acid [1-ethoxy-1-oxo-2-(4-phenoxyphenyl)propan-2-yl] ester IUPAC Name: [1-ethoxy-1-oxo-2-(4-phenoxyphenyl)propan-2-yl] 1,2,4-triazole-1-carboxylate Traditional Name: 1,2,4-triazole-1-carboxylic acid [2-ethoxy-2-keto-1-methyl-1-(4-phenoxyphenyl)ethyl] ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)N3C=NC=N3

Isomeric SMILES

CCOC(=O)C(C)(C1=CC=C(C=C1)OC2=CC=CC=C2)OC(=O)N3C=NC=N3

InChI

InChI=1S/C20H19N3O5/c1-3-26-18(24)20(2,28-19(25)23-14-21-13-22-23)15-9-11-17(12-10-15)27-16-7-5-4-6-8-16/h4-14H,3H2,1-2H3