4-ethyl-1-[3-(1,2,4-triazol-1-yl)propanoylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-ethyl-1-[3-(1,2,4-triazol-1-yl)propanoylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-ethyl-1-[3-(1,2,4-triazol-1-yl)propanoylamino]cyclohexanecarboxylic acid CAS Name: 4-ethyl-1-[[1-oxo-3-(1,2,4-triazol-1-yl)propyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-ethyl-1-[3-(1,2,4-triazol-1-yl)propanoylamino]cyclohexane-1-carboxylic acid Traditional Name: 4-ethyl-1-[3-(1,2,4-triazol-1-yl)propanoylamino]cyclohexanecarboxylic acid Formula: C14H22N4O3 MolecularWeight: 294.34948

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)(C(=O)O)NC(=O)CCN2C=NC=N2

Isomeric SMILES

CCC1CCC(CC1)(C(=O)O)NC(=O)CCN2C=NC=N2

InChI

InChI=1S/C14H22N4O3/c1-2-11-3-6-14(7-4-11,13(20)21)17-12(19)5-8-18-10-15-9-16-18/h9-11H,2-8H2,1H3,(H,17,19)(H,20,21)