9,11,11-trimethyltetradecan-7-yl 1,2,4-triazole-1-carboxylate

Systemtic Name: 9,11,11-trimethyltetradecan-7-yl 1,2,4-triazole-1-carboxylate Openeye Name: (1-hexyl-3,5,5-trimethyl-octyl) 1,2,4-triazole-1-carboxylate CAS Name: 1,2,4-triazole-1-carboxylic acid 9,11,11-trimethyltetradecan-7-yl ester IUPAC Name: 9,11,11-trimethyltetradecan-7-yl 1,2,4-triazole-1-carboxylate Traditional Name: 1,2,4-triazole-1-carboxylic acid (1-hexyl-3,5,5-trimethyl-octyl) ester Formula: C20H37N3O2 MolecularWeight: 351.52668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(C)CC(C)(C)CCC)OC(=O)N1C=NC=N1

Isomeric SMILES

CCCCCCC(CC(C)CC(C)(C)CCC)OC(=O)N1C=NC=N1

InChI

InChI=1S/C20H37N3O2/c1-6-8-9-10-11-18(25-19(24)23-16-21-15-22-23)13-17(3)14-20(4,5)12-7-2/h15-18H,6-14H2,1-5H3