2-[2-[(3-carboxy-2-methyl-5-oxidanyl-5-oxidanylidene-pentan-2-yl)diazenyl]propan-2-yl]butanedioic acid

Systemtic Name: 2-[2-[(3-carboxy-2-methyl-5-oxidanyl-5-oxidanylidene-pentan-2-yl)diazenyl]propan-2-yl]butanedioic acid Openeye Name: 2-[1-(2-carboxy-4-hydroxy-1,1-dimethyl-4-oxo-butyl)azo-1-methyl-ethyl]butanedioic acid CAS Name: 2-[2-(3-carboxy-5-hydroxy-2-methyl-5-oxopentan-2-yl)azopropan-2-yl]butanedioic acid IUPAC Name: 2-[2-[(3-carboxy-5-hydroxy-2-methyl-5-oxopentan-2-yl)diazenyl]propan-2-yl]butanedioic acid Traditional Name: 2-[1-(2-carboxy-4-hydroxy-4-keto-1,1-dimethyl-butyl)azo-1-methyl-ethyl]succinic acid Formula: C14H22N2O8 MolecularWeight: 346.33308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CC(=O)O)C(=O)O)N=NC(C)(C)C(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C(CC(=O)O)C(=O)O)N=NC(C)(C)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C14H22N2O8/c1-13(2,7(11(21)22)5-9(17)18)15-16-14(3,4)8(12(23)24)6-10(19)20/h7-8H,5-6H2,1-4H3,(H,17,18)(H,19,20)(H,21,22)(H,23,24)