ethyl 1-(2-oxidanylnonan-3-yl)-1,2,4-triazole-3-carboxylate

Systemtic Name: ethyl 1-(2-oxidanylnonan-3-yl)-1,2,4-triazole-3-carboxylate Openeye Name: ethyl 1-[1-(1-hydroxyethyl)heptyl]-1,2,4-triazole-3-carboxylate CAS Name: 1-(2-hydroxynonan-3-yl)-1,2,4-triazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxynonan-3-yl)-1,2,4-triazole-3-carboxylate Traditional Name: 1-[1-(1-hydroxyethyl)heptyl]-1,2,4-triazole-3-carboxylic acid ethyl ester Formula: C14H25N3O3 MolecularWeight: 283.3666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)O)N1C=NC(=N1)C(=O)OCC

Isomeric SMILES

CCCCCCC(C(C)O)N1C=NC(=N1)C(=O)OCC

InChI

InChI=1S/C14H25N3O3/c1-4-6-7-8-9-12(11(3)18)17-10-15-13(16-17)14(19)20-5-2/h10-12,18H,4-9H2,1-3H3