ethyl 1-heptyl-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-heptyl-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-heptyltriazole-4-carboxylate CAS Name: 1-heptyl-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-heptyltriazole-4-carboxylate Traditional Name: 1-heptyltriazole-4-carboxylic acid ethyl ester Formula: C12H21N3O2 MolecularWeight: 239.31404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C=C(N=N1)C(=O)OCC

Isomeric SMILES

CCCCCCCN1C=C(N=N1)C(=O)OCC

InChI

InChI=1S/C12H21N3O2/c1-3-5-6-7-8-9-15-10-11(13-14-15)12(16)17-4-2/h10H,3-9H2,1-2H3