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

Systemtic Name: 1-[2-(1,2,4-triazol-1-yl)propanoylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(1,2,4-triazol-1-yl)propanoylamino]cyclohexanecarboxylic acid CAS Name: 1-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(1,2,4-triazol-1-yl)propanoylamino]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-(1,2,4-triazol-1-yl)propanoylamino]cyclohexanecarboxylic acid Formula: C12H18N4O3 MolecularWeight: 266.29632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C(=O)O)N2C=NC=N2

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C(=O)O)N2C=NC=N2

InChI

InChI=1S/C12H18N4O3/c1-9(16-8-13-7-14-16)10(17)15-12(11(18)19)5-3-2-4-6-12/h7-9H,2-6H2,1H3,(H,15,17)(H,18,19)