3-pentyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 3-pentyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 3-pentyltriazole-4-carboxylic acid CAS Name: 3-pentyl-4-triazolecarboxylic acid IUPAC Name: 3-pentyltriazole-4-carboxylic acid Traditional Name: 3-amyltriazole-4-carboxylic acid Formula: C8H13N3O2 MolecularWeight: 183.20772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=CN=N1)C(=O)O

Isomeric SMILES

CCCCCN1C(=CN=N1)C(=O)O

InChI

InChI=1S/C8H13N3O2/c1-2-3-4-5-11-7(8(12)13)6-9-10-11/h6H,2-5H2,1H3,(H,12,13)