(1S,4R,5R)-1-methyl-4,5-bis(oxidanyl)cyclohex-2-ene-1-carboxylic acid

Systemtic Name: (1S,4R,5R)-1-methyl-4,5-bis(oxidanyl)cyclohex-2-ene-1-carboxylic acid Openeye Name: (1S,4R,5R)-4,5-dihydroxy-1-methyl-cyclohex-2-ene-1-carboxylic acid CAS Name: (1S,4R,5R)-4,5-dihydroxy-1-methyl-1-cyclohex-2-enecarboxylic acid IUPAC Name: (1S,4R,5R)-4,5-dihydroxy-1-methylcyclohex-2-ene-1-carboxylic acid Traditional Name: (1S,4R,5R)-4,5-dihydroxy-1-methyl-cyclohex-2-ene-1-carboxylic acid Formula: C8H12O4 MolecularWeight: 172.17848

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(C=C1)O)O)C(=O)O

Isomeric SMILES

C[C@@]1(C[C@H]([C@@H](C=C1)O)O)C(=O)O

InChI

InChI=1S/C8H12O4/c1-8(7(11)12)3-2-5(9)6(10)4-8/h2-3,5-6,9-10H,4H2,1H3,(H,11,12)/t5-,6-,8-/m1/s1