3,9-diethyltridecyl 1,2,4-triazole-1-carboxylate

Systemtic Name: 3,9-diethyltridecyl 1,2,4-triazole-1-carboxylate Openeye Name: 3,9-diethyltridecyl 1,2,4-triazole-1-carboxylate CAS Name: 1,2,4-triazole-1-carboxylic acid 3,9-diethyltridecyl ester IUPAC Name: 3,9-diethyltridecyl 1,2,4-triazole-1-carboxylate Traditional Name: 1,2,4-triazole-1-carboxylic acid 3,9-diethyltridecyl ester Formula: C20H37N3O2 MolecularWeight: 351.52668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CCCCCC(CC)CCOC(=O)N1C=NC=N1

Isomeric SMILES

CCCCC(CC)CCCCCC(CC)CCOC(=O)N1C=NC=N1

InChI

InChI=1S/C20H37N3O2/c1-4-7-11-18(5-2)12-9-8-10-13-19(6-3)14-15-25-20(24)23-17-21-16-22-23/h16-19H,4-15H2,1-3H3