5-[2-(1H-imidazol-5-yl)ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid

Systemtic Name: 5-[2-(1H-imidazol-5-yl)ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid Openeye Name: 5-hydroxy-5-[2-(1H-imidazol-5-yl)ethyl]-6-methyl-3-oxo-heptanoic acid CAS Name: 5-hydroxy-5-[2-(1H-imidazol-5-yl)ethyl]-6-methyl-3-oxoheptanoic acid IUPAC Name: 5-hydroxy-5-[2-(1H-imidazol-5-yl)ethyl]-6-methyl-3-oxoheptanoic acid Traditional Name: 5-hydroxy-5-[2-(1H-imidazol-5-yl)ethyl]-3-keto-6-methyl-enanthic acid Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC1=CN=CN1)(CC(=O)CC(=O)O)O

Isomeric SMILES

CC(C)C(CCC1=CN=CN1)(CC(=O)CC(=O)O)O

InChI

InChI=1S/C13H20N2O4/c1-9(2)13(19,6-11(16)5-12(17)18)4-3-10-7-14-8-15-10/h7-9,19H,3-6H2,1-2H3,(H,14,15)(H,17,18)