2-(2,5-dimethylphenoxy)ethyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: 2-(2,5-dimethylphenoxy)ethyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: 2-(2,5-dimethylphenoxy)ethyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 6-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid 2-(2,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(2,5-dimethylphenoxy)ethyl 6-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 6-(1,2,4-triazol-1-yl)nicotinic acid 2-(2,5-dimethylphenoxy)ethyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCOC(=O)C2=CN=C(C=C2)N3C=NC=N3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCOC(=O)C2=CN=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C18H18N4O3/c1-13-3-4-14(2)16(9-13)24-7-8-25-18(23)15-5-6-17(20-10-15)22-12-19-11-21-22/h3-6,9-12H,7-8H2,1-2H3