4-oxidanylidene-2-(propanoylamino)-5-[5-(trifluoromethyl)-1,2,3,4-tetrazol-2-yl]pentanoic acid

Systemtic Name: 4-oxidanylidene-2-(propanoylamino)-5-[5-(trifluoromethyl)-1,2,3,4-tetrazol-2-yl]pentanoic acid Openeye Name: 4-oxo-2-(propanoylamino)-5-[5-(trifluoromethyl)tetrazol-2-yl]pentanoic acid CAS Name: 4-oxo-2-(1-oxopropylamino)-5-[5-(trifluoromethyl)-2-tetrazolyl]pentanoic acid IUPAC Name: 4-oxo-2-(propanoylamino)-5-[5-(trifluoromethyl)tetrazol-2-yl]pentanoic acid Traditional Name: 4-keto-2-propionamido-5-[5-(trifluoromethyl)tetrazol-2-yl]valeric acid Formula: C10H12F3N5O4 MolecularWeight: 323.22859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(CC(=O)CN1N=C(N=N1)C(F)(F)F)C(=O)O

Isomeric SMILES

CCC(=O)NC(CC(=O)CN1N=C(N=N1)C(F)(F)F)C(=O)O

InChI

InChI=1S/C10H12F3N5O4/c1-2-7(20)14-6(8(21)22)3-5(19)4-18-16-9(15-17-18)10(11,12)13/h6H,2-4H2,1H3,(H,14,20)(H,21,22)