2-imidazol-1-yl-3,5-bis(oxidanyl)-2-propan-2-yl-heptanoic acid

Systemtic Name: 2-imidazol-1-yl-3,5-bis(oxidanyl)-2-propan-2-yl-heptanoic acid Openeye Name: 3,5-dihydroxy-2-imidazol-1-yl-2-isopropyl-heptanoic acid CAS Name: 3,5-dihydroxy-2-(1-imidazolyl)-2-propan-2-ylheptanoic acid IUPAC Name: 3,5-dihydroxy-2-imidazol-1-yl-2-propan-2-ylheptanoic acid Traditional Name: 3,5-dihydroxy-2-imidazol-1-yl-2-isopropyl-enanthic acid Formula: C13H22N2O4 MolecularWeight: 270.32478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(C(C)C)(C(=O)O)N1C=CN=C1)O)O

Isomeric SMILES

CCC(CC(C(C(C)C)(C(=O)O)N1C=CN=C1)O)O

InChI

InChI=1S/C13H22N2O4/c1-4-10(16)7-11(17)13(9(2)3,12(18)19)15-6-5-14-8-15/h5-6,8-11,16-17H,4,7H2,1-3H3,(H,18,19)