ethyl 3-methyl-2-(1,2,4-triazol-1-yl)butanoate

Systemtic Name: ethyl 3-methyl-2-(1,2,4-triazol-1-yl)butanoate Openeye Name: ethyl 3-methyl-2-(1,2,4-triazol-1-yl)butanoate CAS Name: 3-methyl-2-(1,2,4-triazol-1-yl)butanoic acid ethyl ester IUPAC Name: ethyl 3-methyl-2-(1,2,4-triazol-1-yl)butanoate Traditional Name: 3-methyl-2-(1,2,4-triazol-1-yl)butyric acid ethyl ester Formula: C9H15N3O2 MolecularWeight: 197.2343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)N1C=NC=N1

Isomeric SMILES

CCOC(=O)C(C(C)C)N1C=NC=N1

InChI

InChI=1S/C9H15N3O2/c1-4-14-9(13)8(7(2)3)12-6-10-5-11-12/h5-8H,4H2,1-3H3