4-butyl-2,3-bis(oxidanyl)bicyclo[2.2.1]heptane-5-carboxylate

Systemtic Name: 4-butyl-2,3-bis(oxidanyl)bicyclo[2.2.1]heptane-5-carboxylate Openeye Name: 1-butyl-5,6-dihydroxy-norbornane-2-carboxylate CAS Name: 4-butyl-2,3-dihydroxy-5-bicyclo[2.2.1]heptanecarboxylate IUPAC Name: 4-butyl-2,3-dihydroxybicyclo[2.2.1]heptane-5-carboxylate Traditional Name: 1-butyl-5,6-dihydroxy-norbornane-2-carboxylate Formula: C12H19O4- MolecularWeight: 227.27686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CC(CC1C(=O)[O-])C(C2O)O

Isomeric SMILES

CCCCC12CC(CC1C(=O)[O-])C(C2O)O

InChI

InChI=1S/C12H20O4/c1-2-3-4-12-6-7(9(13)10(12)14)5-8(12)11(15)16/h7-10,13-14H,2-6H2,1H3,(H,15,16)/p-1